4-chloranyl-N-[piperazin-1-ylsulfonyl-(5-pyridin-3-ylcarbonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 4-chloranyl-N-[piperazin-1-ylsulfonyl-(5-pyridin-3-ylcarbonylthiophen-2-yl)methyl]benzamide Openeye Name: 4-chloro-N-[piperazin-1-ylsulfonyl-[5-(pyridine-3-carbonyl)-2-thienyl]methyl]benzamide CAS Name: 4-chloro-N-[[5-[oxo(3-pyridinyl)methyl]-2-thiophenyl]-(1-piperazinylsulfonyl)methyl]benzamide IUPAC Name: 4-chloro-N-[piperazin-1-ylsulfonyl-[5-(pyridine-3-carbonyl)thiophen-2-yl]methyl]benzamide Traditional Name: 4-chloro-N-[(5-nicotinoyl-2-thienyl)-piperazinosulfonyl-methyl]benzamide Formula: C22H21ClN4O4S2 MolecularWeight: 505.00954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C(C2=CC=C(S2)C(=O)C3=CN=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C(C2=CC=C(S2)C(=O)C3=CN=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN4O4S2/c23-17-5-3-15(4-6-17)21(29)26-22(33(30,31)27-12-10-24-11-13-27)19-8-7-18(32-19)20(28)16-2-1-9-25-14-16/h1-9,14,22,24H,10-13H2,(H,26,29)