N-(4-azanylcyclohexyl)-N-[[3-[(4-cyanophenyl)carbonylamino]phenyl]methyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[3-[(4-cyanophenyl)carbonylamino]phenyl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-(4-aminocyclohexyl)-N-[[3-[(4-cyanobenzoyl)amino]phenyl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-(4-aminocyclohexyl)-N-[[3-[[(4-cyanophenyl)-oxomethyl]amino]phenyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[3-[(4-cyanobenzoyl)amino]phenyl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-(4-aminocyclohexyl)-N-[3-[(4-cyanobenzoyl)amino]benzyl]-3,4-dimethoxy-benzamide Formula: C30H32N4O4 MolecularWeight: 512.59948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C#N)C4CCC(CC4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C#N)C4CCC(CC4)N)OC

InChI

InChI=1S/C30H32N4O4/c1-37-27-15-10-23(17-28(27)38-2)30(36)34(26-13-11-24(32)12-14-26)19-21-4-3-5-25(16-21)33-29(35)22-8-6-20(18-31)7-9-22/h3-10,15-17,24,26H,11-14,19,32H2,1-2H3,(H,33,35)