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

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

Isomeric SMILES

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

InChI

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