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

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-4-carboxamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-4-carboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]pyridine-4-carboxamide Traditional Name: N-[4-[[(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=C(C=C1)NC(=O)C2=CC=NC=C2)C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2=CC=NC=C2)C3CCC(CC3)N

InChI

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