4-(4-chlorophenyl)sulfonyl-N-(2-cyanophenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-(2-cyanophenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-(2-cyanophenyl)piperazine-1-carbothioamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-(2-cyanophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-(2-cyanophenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(2-cyanophenyl)piperazine-1-carbothioamide Formula: C18H17ClN4O2S2 MolecularWeight: 420.93618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=S)NC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4O2S2/c19-15-5-7-16(8-6-15)27(24,25)23-11-9-22(10-12-23)18(26)21-17-4-2-1-3-14(17)13-20/h1-8H,9-12H2,(H,21,26)