4-oxidanylidene-1-(phenylmethyl)-N-propan-2-yl-5-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxamide

Systemtic Name: 4-oxidanylidene-1-(phenylmethyl)-N-propan-2-yl-5-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxamide Openeye Name: 1-benzyl-N-isopropyl-4-oxo-5-[4-(2-thienylmethyl)piperazine-1-carbonyl]pyridine-3-carboxamide CAS Name: 4-oxo-5-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]-1-(phenylmethyl)-N-propan-2-yl-3-pyridinecarboxamide IUPAC Name: 1-benzyl-4-oxo-N-propan-2-yl-5-[4-(thiophen-2-ylmethyl)piperazine-1-carbonyl]pyridine-3-carboxamide Traditional Name: 1-benzyl-N-isopropyl-4-keto-5-[4-(2-thenyl)piperazine-1-carbonyl]nicotinamide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)CC3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=CN(C=C(C1=O)C(=O)N2CCN(CC2)CC3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3S/c1-19(2)27-25(32)22-17-29(15-20-7-4-3-5-8-20)18-23(24(22)31)26(33)30-12-10-28(11-13-30)16-21-9-6-14-34-21/h3-9,14,17-19H,10-13,15-16H2,1-2H3,(H,27,32)