4-(2-chlorophenyl)carbonyl-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2-chlorophenyl)carbonyl-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide Openeye Name: 4-(2-chlorobenzoyl)-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-N-[2-(phenylthio)ethyl]-1-piperazinecarbothioamide IUPAC Name: 4-(2-chlorobenzoyl)-N-(2-phenylsulfanylethyl)piperazine-1-carbothioamide Traditional Name: 4-(2-chlorobenzoyl)-N-[2-(phenylthio)ethyl]piperazine-1-carbothioamide Formula: C20H22ClN3OS2 MolecularWeight: 419.99118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2Cl)C(=S)NCCSC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2Cl)C(=S)NCCSC3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3OS2/c21-18-9-5-4-8-17(18)19(25)23-11-13-24(14-12-23)20(26)22-10-15-27-16-6-2-1-3-7-16/h1-9H,10-15H2,(H,22,26)