N-[2-[2-[[3-(aminomethyl)cyclohexyl]methylamino]-2-oxidanylidene-ethyl]phenyl]-3-cyano-benzamide

Systemtic Name: N-[2-[2-[[3-(aminomethyl)cyclohexyl]methylamino]-2-oxidanylidene-ethyl]phenyl]-3-cyano-benzamide Openeye Name: N-[2-[2-[[3-(aminomethyl)cyclohexyl]methylamino]-2-oxo-ethyl]phenyl]-3-cyano-benzamide CAS Name: N-[2-[2-[[3-(aminomethyl)cyclohexyl]methylamino]-2-oxoethyl]phenyl]-3-cyanobenzamide IUPAC Name: N-[2-[2-[[3-(aminomethyl)cyclohexyl]methylamino]-2-oxoethyl]phenyl]-3-cyanobenzamide Traditional Name: N-[2-[2-[[3-(aminomethyl)cyclohexyl]methylamino]-2-keto-ethyl]phenyl]-3-cyano-benzamide Formula: C24H28N4O2 MolecularWeight: 404.50472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=O)CC2=CC=CC=C2NC(=O)C3=CC=CC(=C3)C#N)CN

Isomeric SMILES

C1CC(CC(C1)CNC(=O)CC2=CC=CC=C2NC(=O)C3=CC=CC(=C3)C#N)CN

InChI

InChI=1S/C24H28N4O2/c25-14-17-5-3-7-19(11-17)16-27-23(29)13-20-8-1-2-10-22(20)28-24(30)21-9-4-6-18(12-21)15-26/h1-2,4,6,8-10,12,17,19H,3,5,7,11,13-14,16,25H2,(H,27,29)(H,28,30)