N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Base Information

Chemical Name:N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide
CAS No.:23903-48-2
Molecular Formula:C16H14 N2 O S
Molecular Weight:282.366
Hs Code.:
NSC Number:153311
DSSTox Substance ID:DTXSID50946702
ChEMBL ID:CHEMBL233000
Mol file:23903-48-2.mol

Synonyms:23903-48-2;N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide;N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide;CHEMBL233000;N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)benzamide;NSC153311;Cambridge id 5107420;TimTec1_002133;Oprea1_099615;Oprea1_438336;SCHEMBL3285611;DTXSID50946702;HMS1540A21;N-(3-Cyano-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-benzamide;BDBM50241256;STK387290;ZINC00135906;AKOS000678779;NSC-153311;CS-0333512;AB00073818-01;AG-205/32539042;SR-01000396994;SR-01000396994-1;BRD-K43556194-001-01-9;N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl;F0016-0417;F0878-0014;2-Benzoylamino-3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophene;N-(3-Cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzenecarboximidic acid

Suppliers and Price of N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide 97%
5g
$ 874.00

American Custom Chemicals Corporation
N-(3-CYANO-4,5,6,7-TETRAHYDRO-BENZO[B]THIOPHEN-2-YL)-BENZAMIDE 95.00%
5MG
$ 496.47

Total 5 raw suppliers

Chemical Property of N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Chemical Property:

Vapor Pressure:1.2E-06mmHg at 25°C
Boiling Point:401.3°Cat760mmHg
Flash Point:196.5°C
PSA：81.13000
Density:1.3g/cm³
LogP:3.82388
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:282.08268425
Heavy Atom Count:20
Complexity:410

Purity/Quality:

99% ^*data from raw suppliers

N-(3-Cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C#N

Technology Process of N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

There total 5 articles about N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 97.0%

: 4651-91-6
3-cyano-2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene

: 98-88-4
benzoyl chloride

: 23903-48-2
N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide

Guidance literature:: With hydrogenchloride; In pyridine;

Reference yield:

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 23903-48-2
N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: sulfur; Et₂NH / ethanol / 20 °C

2: pyridine / 80 °C

With pyridine; sulfur; diethylamine; In ethanol;
DOI:10.1016/j.bmcl.2006.12.003

Reference yield:

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 23903-48-2
N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: sulfur; morpholine / ethanol

2: acetone / Reflux

With morpholine; sulfur; In ethanol; acetone;