Benzenesulfonic acid, 3-methyl-4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide

Base Information

• Chemical Name: Benzenesulfonic acid, 3-methyl-4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide
• CAS No.: 116854-90-1
• Molecular Formula: C21H19 N5 O2 S3
• Molecular Weight: 469.6029
• DSSTox Substance ID: DTXSID60151562

Synonyms:3-Methyl-4-(((phenylamino)carbonyl)amino)benzenesulfonic acid 2-(2-benzothiazolyl)hydrazide;Benzenesulfonic acid, 3-methyl-4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide;116854-90-1;DTXSID60151562;LS-32023

Chemical Property of Benzenesulfonic acid, 3-methyl-4-(((phenylamino)thioxomethyl)amino)-, 2-(2-benzothiazolyl)hydrazide

Chemical Property:

• Vapor Pressure: 2.37E-16mmHg at 25°C
• Boiling Point: 641.5°Cat760mmHg
• Flash Point: 341.8°C
• Density: 1.52g/cm³
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 469.07008839
• Heavy Atom Count: 31
• Complexity: 710

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)S(=O)(=O)NNC2=NC3=CC=CC=C3S2)NC(=S)NC4=CC=CC=C4

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