N-[5-[3-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-2-morpholin-4-yl-phenyl]-4-cyano-benzamide

Systemtic Name: N-[5-[3-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-2-morpholin-4-yl-phenyl]-4-cyano-benzamide Openeye Name: N-[5-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-morpholino-phenyl]-4-cyano-benzamide CAS Name: N-[5-[3-[[(4-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-2-(4-morpholinyl)phenyl]-4-cyanobenzamide IUPAC Name: N-[5-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-morpholin-4-ylphenyl]-4-cyanobenzamide Traditional Name: N-[5-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-morpholino-phenyl]-4-cyano-benzamide Formula: C35H39N5O3 MolecularWeight: 577.71586

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CC2=CC=CC(=C2)C3=CC(=C(C=C3)N4CCOCC4)NC(=O)C5=CC=C(C=C5)C#N)C6CCC(CC6)N

Isomeric SMILES

C1CC1C(=O)N(CC2=CC=CC(=C2)C3=CC(=C(C=C3)N4CCOCC4)NC(=O)C5=CC=C(C=C5)C#N)C6CCC(CC6)N

InChI

InChI=1S/C35H39N5O3/c36-22-24-4-6-26(7-5-24)34(41)38-32-21-29(10-15-33(32)39-16-18-43-19-17-39)28-3-1-2-25(20-28)23-40(35(42)27-8-9-27)31-13-11-30(37)12-14-31/h1-7,10,15,20-21,27,30-31H,8-9,11-14,16-19,23,37H2,(H,38,41)