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Basic Information
CAS No.: 58889-16-0
Name: 3-(2-Chloro-9H-thioxanthen-9-ylidene)-N,N-dimethyl-1-propanamine acetate
Molecular Structure:
Molecular Structure of 58889-16-0 (3-(2-Chloro-9H-thioxanthen-9-ylidene)-N,N-dimethyl-1-propanamine acetate)
Formula: C18H18ClNS.C2H4O2
Molecular Weight: 375.11
Synonyms: 3-(2-Chloro-9H-thioxanthen-9-ylidene)-N,N-dimethyl-1-propanamine aceta
PSA: 65.84000
LogP: 5.27890
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    Molecular Formula C18H18ClNS.C2H4O2 Molecular Weight 375.11 CAS Registry Number 58889-16-0 NameChlorprothixene acetateSyno…

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Specification

The Chlorprothixene acetate, with CAS registry number 58889-16-0, has the systematic name of 1-propanamine, 3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N-dimethyl-, (3Z)-, acetate (1:1). Besides this, it is also called (3Z)-3-(2-Chloro-9H-thioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine acetate (1:1). And the chemical formula of this chemical is C18H18ClNS.C2H4O2.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)O.CN(C)CC/C=C\1/c2ccccc2Sc3c1cc(cc3)Cl
(2)InChI: InChI=1/C18H18ClNS.C2H4O2/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18;1-2(3)4/h3-4,6-10,12H,5,11H2,1-2H3;1H3,(H,3,4)/b14-7-;
(3)InChIKey: XGKNWADXVDIFDQ-KIUKIJHYBQ
(4)Std. InChI: InChI=1S/C18H18ClNS.C2H4O2/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18;1-2(3)4/h3-4,6-10,12H,5,11H2,1-2H3;1H3,(H,3,4)/b14-7-;
(5)Std. InChIKey: XGKNWADXVDIFDQ-KIUKIJHYSA-N