N5-ethyl-N3-methyl-4-oxidanylidene-1-(phenylmethyl)-N3-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide

Systemtic Name: N5-ethyl-N3-methyl-4-oxidanylidene-1-(phenylmethyl)-N3-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide Openeye Name: 1-benzyl-N5-ethyl-N3-methyl-4-oxo-N3-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide CAS Name: N5-ethyl-N3-methyl-4-oxo-1-(phenylmethyl)-N3-[[4-(1-pyrazolyl)phenyl]methyl]pyridine-3,5-dicarboxamide IUPAC Name: 1-benzyl-5-N-ethyl-3-N-methyl-4-oxo-3-N-[(4-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide Traditional Name: 1-benzyl-N'-ethyl-4-keto-N-methyl-N-(4-pyrazol-1-ylbenzyl)dinicotinamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N(C)CC2=CC=C(C=C2)N3C=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)N(C)CC2=CC=C(C=C2)N3C=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O3/c1-3-28-26(34)23-18-31(17-20-8-5-4-6-9-20)19-24(25(23)33)27(35)30(2)16-21-10-12-22(13-11-21)32-15-7-14-29-32/h4-15,18-19H,3,16-17H2,1-2H3,(H,28,34)