4-(4-cyanophenyl)sulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]piperazine-1-carboxamide Openeye Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(3-thienylmethylsulfanyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(3-thiophenylmethylthio)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]piperazine-1-carboxamide Traditional Name: 4-(4-cyanophenyl)sulfonyl-N-[2-(3-thenylthio)ethyl]piperazine-1-carboxamide Formula: C19H22N4O3S3 MolecularWeight: 450.59798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCSCC2=CSC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)NCCSCC2=CSC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H22N4O3S3/c20-13-16-1-3-18(4-2-16)29(25,26)23-9-7-22(8-10-23)19(24)21-6-12-28-15-17-5-11-27-14-17/h1-5,11,14H,6-10,12,15H2,(H,21,24)