1-butan-2-yl-4-oxidanylidene-N-prop-2-enyl-5-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxamide

Systemtic Name: 1-butan-2-yl-4-oxidanylidene-N-prop-2-enyl-5-[4-(thiophen-2-ylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxamide Openeye Name: N-allyl-4-oxo-1-sec-butyl-5-[4-(2-thienylmethyl)piperazine-1-carbonyl]pyridine-3-carboxamide CAS Name: 1-butan-2-yl-4-oxo-5-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]-N-prop-2-enyl-3-pyridinecarboxamide IUPAC Name: 1-butan-2-yl-4-oxo-N-prop-2-enyl-5-[4-(thiophen-2-ylmethyl)piperazine-1-carbonyl]pyridine-3-carboxamide Traditional Name: N-allyl-4-keto-1-sec-butyl-5-[4-(2-thenyl)piperazine-1-carbonyl]nicotinamide Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)CC3=CC=CS3)C(=O)NCC=C

Isomeric SMILES

CCC(C)N1C=C(C(=O)C(=C1)C(=O)N2CCN(CC2)CC3=CC=CS3)C(=O)NCC=C

InChI

InChI=1S/C23H30N4O3S/c1-4-8-24-22(29)19-15-27(17(3)5-2)16-20(21(19)28)23(30)26-11-9-25(10-12-26)14-18-7-6-13-31-18/h4,6-7,13,15-17H,1,5,8-12,14H2,2-3H3,(H,24,29)