N5-[(4-methylphenyl)methyl]-4-oxidanylidene-1-(2-pyridin-2-ylethyl)-N3-(thiophen-2-ylmethyl)pyridine-3,5-dicarboxamide

Systemtic Name: N5-[(4-methylphenyl)methyl]-4-oxidanylidene-1-(2-pyridin-2-ylethyl)-N3-(thiophen-2-ylmethyl)pyridine-3,5-dicarboxamide Openeye Name: 4-oxo-N5-(p-tolylmethyl)-1-[2-(2-pyridyl)ethyl]-N3-(2-thienylmethyl)pyridine-3,5-dicarboxamide CAS Name: N5-[(4-methylphenyl)methyl]-4-oxo-1-[2-(2-pyridinyl)ethyl]-N3-(thiophen-2-ylmethyl)pyridine-3,5-dicarboxamide IUPAC Name: 5-N-[(4-methylphenyl)methyl]-4-oxo-1-(2-pyridin-2-ylethyl)-3-N-(thiophen-2-ylmethyl)pyridine-3,5-dicarboxamide Traditional Name: 4-keto-N'-(4-methylbenzyl)-1-[2-(2-pyridyl)ethyl]-N-(2-thenyl)dinicotinamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC=CS3)CCC4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC=CS3)CCC4=CC=CC=N4

InChI

InChI=1S/C27H26N4O3S/c1-19-7-9-20(10-8-19)15-29-26(33)23-17-31(13-11-21-5-2-3-12-28-21)18-24(25(23)32)27(34)30-16-22-6-4-14-35-22/h2-10,12,14,17-18H,11,13,15-16H2,1H3,(H,29,33)(H,30,34)