N-(4-azanylcyclohexyl)-3-[(4-cyanophenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-[(4-cyanophenyl)carbonylamino]-4-[4-(phenylcarbonyl)piperazin-1-yl]benzamide Openeye Name: N-(4-aminocyclohexyl)-4-(4-benzoylpiperazin-1-yl)-3-[(4-cyanobenzoyl)amino]benzamide CAS Name: N-(4-aminocyclohexyl)-4-(4-benzoyl-1-piperazinyl)-3-[[(4-cyanophenyl)-oxomethyl]amino]benzamide IUPAC Name: N-(4-aminocyclohexyl)-4-(4-benzoylpiperazin-1-yl)-3-[(4-cyanobenzoyl)amino]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-(4-benzoylpiperazino)-3-[(4-cyanobenzoyl)amino]benzamide Formula: C32H34N6O3 MolecularWeight: 550.65076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C32H34N6O3/c33-21-22-6-8-23(9-7-22)30(39)36-28-20-25(31(40)35-27-13-11-26(34)12-14-27)10-15-29(28)37-16-18-38(19-17-37)32(41)24-4-2-1-3-5-24/h1-10,15,20,26-27H,11-14,16-19,34H2,(H,35,40)(H,36,39)