6-methyl-2-[1-[3-(2-nitrophenyl)prop-2-enoyl]piperidin-4-yl]-N-(2-thiophen-2-ylethyl)pyridine-3-carboxamide

Systemtic Name: 6-methyl-2-[1-[3-(2-nitrophenyl)prop-2-enoyl]piperidin-4-yl]-N-(2-thiophen-2-ylethyl)pyridine-3-carboxamide Openeye Name: 6-methyl-2-[1-[3-(2-nitrophenyl)prop-2-enoyl]-4-piperidyl]-N-[2-(2-thienyl)ethyl]pyridine-3-carboxamide CAS Name: 6-methyl-2-[1-[3-(2-nitrophenyl)-1-oxoprop-2-enyl]-4-piperidinyl]-N-(2-thiophen-2-ylethyl)-3-pyridinecarboxamide IUPAC Name: 6-methyl-2-[1-[3-(2-nitrophenyl)prop-2-enoyl]piperidin-4-yl]-N-(2-thiophen-2-ylethyl)pyridine-3-carboxamide Traditional Name: 6-methyl-2-[1-[3-(2-nitrophenyl)acryloyl]-4-piperidyl]-N-[2-(2-thienyl)ethyl]nicotinamide Formula: C27H28N4O4S MolecularWeight: 504.60062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCC2=CC=CS2)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCC2=CC=CS2)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C27H28N4O4S/c1-19-8-10-23(27(33)28-15-12-22-6-4-18-36-22)26(29-19)21-13-16-30(17-14-21)25(32)11-9-20-5-2-3-7-24(20)31(34)35/h2-11,18,21H,12-17H2,1H3,(H,28,33)