3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide

Systemtic Name: 3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide Openeye Name: 3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-N-(3-pyridylmethyl)thiophene-2-carboxamide CAS Name: 3-[[4-(4-chlorophenyl)-1-piperazinyl]sulfonyl]-N-(3-pyridinylmethyl)-2-thiophenecarboxamide IUPAC Name: 3-[4-(4-chlorophenyl)piperazin-1-yl]sulfonyl-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide Traditional Name: 3-[4-(4-chlorophenyl)piperazino]sulfonyl-N-(3-pyridylmethyl)thiophene-2-carboxamide Formula: C21H21ClN4O3S2 MolecularWeight: 476.99944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)C3=C(SC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H21ClN4O3S2/c22-17-3-5-18(6-4-17)25-9-11-26(12-10-25)31(28,29)19-7-13-30-20(19)21(27)24-15-16-2-1-8-23-14-16/h1-8,13-14H,9-12,15H2,(H,24,27)