methyl N-[3-[[(4-azanylcyclohexyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]carbamate

Systemtic Name: methyl N-[3-[[(4-azanylcyclohexyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]carbamate Openeye Name: methyl N-[3-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]carbamate CAS Name: N-[3-[[(4-aminocyclohexyl)-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[3-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]carbamate Traditional Name: N-[3-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]carbamic acid methyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=CC(=C1)CN(C2CCC(CC2)N)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)NC1=CC=CC(=C1)CN(C2CCC(CC2)N)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H26N4O3/c1-30-23(29)26-20-4-2-3-17(13-20)15-27(21-11-9-19(25)10-12-21)22(28)18-7-5-16(14-24)6-8-18/h2-8,13,19,21H,9-12,15,25H2,1H3,(H,26,29)