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

Systemtic Name: N-[2-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[2-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide CAS Name: N-[2-[[(4-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[2-[[(4-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=CC=C1NC(=O)C2=CN=CC=C2)C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=CC=C1NC(=O)C2=CN=CC=C2)C3CCC(CC3)N

InChI

InChI=1S/C25H34N4O2/c1-25(2,3)15-23(30)29(21-12-10-20(26)11-13-21)17-19-7-4-5-9-22(19)28-24(31)18-8-6-14-27-16-18/h4-9,14,16,20-21H,10-13,15,17,26H2,1-3H3,(H,28,31)