N-[4-[[(2-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]nicotinamide Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CN=CC=C2)C3CCCCC3N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CN=CC=C2)C3CCCCC3N

InChI

InChI=1S/C25H34N4O2/c1-25(2,3)15-23(30)29(22-9-5-4-8-21(22)26)17-18-10-12-20(13-11-18)28-24(31)19-7-6-14-27-16-19/h6-7,10-14,16,21-22H,4-5,8-9,15,17,26H2,1-3H3,(H,28,31)