5-[[4-butyl-2-methyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-6-oxidanylidene-pyrimidin-5-yl]methyl]-2-phenyl-benzenecarbonitrile

Systemtic Name: 5-[[4-butyl-2-methyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-6-oxidanylidene-pyrimidin-5-yl]methyl]-2-phenyl-benzenecarbonitrile Openeye Name: 5-[[4-butyl-2-methyl-1-(2-morpholino-2-oxo-ethyl)-6-oxo-pyrimidin-5-yl]methyl]-2-phenyl-benzonitrile CAS Name: 5-[[4-butyl-2-methyl-1-[2-(4-morpholinyl)-2-oxoethyl]-6-oxo-5-pyrimidinyl]methyl]-2-phenylbenzonitrile IUPAC Name: 5-[[4-butyl-2-methyl-1-(2-morpholin-4-yl-2-oxoethyl)-6-oxopyrimidin-5-yl]methyl]-2-phenylbenzonitrile Traditional Name: 5-[[4-butyl-6-keto-1-(2-keto-2-morpholino-ethyl)-2-methyl-pyrimidin-5-yl]methyl]-2-phenyl-benzonitrile Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C(=N1)C)CC(=O)N2CCOCC2)CC3=CC(=C(C=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCCCC1=C(C(=O)N(C(=N1)C)CC(=O)N2CCOCC2)CC3=CC(=C(C=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C29H32N4O3/c1-3-4-10-27-26(18-22-11-12-25(24(17-22)19-30)23-8-6-5-7-9-23)29(35)33(21(2)31-27)20-28(34)32-13-15-36-16-14-32/h5-9,11-12,17H,3-4,10,13-16,18,20H2,1-2H3