4-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide Openeye Name: 4-[(5-chloro-2-thienyl)sulfonyl]-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonyl]-N-[2-(phenylthio)ethyl]-1-piperazinecarbothioamide IUPAC Name: 4-(5-chlorothiophen-2-yl)sulfonyl-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide Traditional Name: 4-[(5-chloro-2-thienyl)sulfonyl]-N-[2-(phenylthio)ethyl]piperazine-1-carbothioamide Formula: C17H20ClN3O2S4 MolecularWeight: 462.0726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CCN1C(=S)NCCSC2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H20ClN3O2S4/c18-15-6-7-16(26-15)27(22,23)21-11-9-20(10-12-21)17(24)19-8-13-25-14-4-2-1-3-5-14/h1-7H,8-13H2,(H,19,24)