4-methoxy-2-[1-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)ethylideneamino]-5-phenyl-benzenecarbonitrile

Systemtic Name: 4-methoxy-2-[1-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)ethylideneamino]-5-phenyl-benzenecarbonitrile Openeye Name: 4-methoxy-2-[1-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]ethylideneamino]-5-phenyl-benzonitrile CAS Name: 4-methoxy-2-[1-[4-[4-morpholinyl(oxo)methyl]-1,4-diazepan-1-yl]ethylideneamino]-5-phenylbenzonitrile IUPAC Name: 4-methoxy-2-[1-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]ethylideneamino]-5-phenylbenzonitrile Traditional Name: 4-methoxy-2-[1-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]ethylideneamino]-5-phenyl-benzonitrile Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC(=C(C=C1C#N)C2=CC=CC=C2)OC)N3CCCN(CC3)C(=O)N4CCOCC4

Isomeric SMILES

CC(=NC1=CC(=C(C=C1C#N)C2=CC=CC=C2)OC)N3CCCN(CC3)C(=O)N4CCOCC4

InChI

InChI=1S/C26H31N5O3/c1-20(29-9-6-10-30(12-11-29)26(32)31-13-15-34-16-14-31)28-24-18-25(33-2)23(17-22(24)19-27)21-7-4-3-5-8-21/h3-5,7-8,17-18H,6,9-16H2,1-2H3