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

Systemtic Name: N5-(cyclohexylmethyl)-1-cyclopropyl-4-oxidanylidene-N3-[(3-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide Openeye Name: N5-(cyclohexylmethyl)-1-cyclopropyl-4-oxo-N3-[(3-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide CAS Name: N5-(cyclohexylmethyl)-1-cyclopropyl-4-oxo-N3-[[3-(1-pyrazolyl)phenyl]methyl]pyridine-3,5-dicarboxamide IUPAC Name: 5-N-(cyclohexylmethyl)-1-cyclopropyl-4-oxo-3-N-[(3-pyrazol-1-ylphenyl)methyl]pyridine-3,5-dicarboxamide Traditional Name: N'-(cyclohexylmethyl)-1-cyclopropyl-4-keto-N-(3-pyrazol-1-ylbenzyl)dinicotinamide Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC(=CC=C3)N4C=CC=N4)C5CC5

Isomeric SMILES

C1CCC(CC1)CNC(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CC(=CC=C3)N4C=CC=N4)C5CC5

InChI

InChI=1S/C27H31N5O3/c33-25-23(26(34)28-15-19-6-2-1-3-7-19)17-31(21-10-11-21)18-24(25)27(35)29-16-20-8-4-9-22(14-20)32-13-5-12-30-32/h4-5,8-9,12-14,17-19,21H,1-3,6-7,10-11,15-16H2,(H,28,34)(H,29,35)