N-[4-[[(4-azanylcyclohexyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]morpholine-4-carboxamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]morpholine-4-carboxamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]morpholine-4-carboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]-4-morpholinecarboxamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]morpholine-4-carboxamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]morpholine-4-carboxamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=C(C=C2)NC(=O)N3CCOCC3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=C(C=C2)NC(=O)N3CCOCC3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H31N5O3/c27-17-19-1-5-21(6-2-19)25(32)31(24-11-7-22(28)8-12-24)18-20-3-9-23(10-4-20)29-26(33)30-13-15-34-16-14-30/h1-6,9-10,22,24H,7-8,11-16,18,28H2,(H,29,33)