(5Z)-5-[(2,5-dimethoxy-4-pyrrolidin-1-yl-phenyl)methylidene]-1-pyridin-3-yl-1,3-diazinane-2,4,6-trione

Systemtic Name: (5Z)-5-[(2,5-dimethoxy-4-pyrrolidin-1-yl-phenyl)methylidene]-1-pyridin-3-yl-1,3-diazinane-2,4,6-trione Openeye Name: (5Z)-5-[(2,5-dimethoxy-4-pyrrolidin-1-yl-phenyl)methylene]-1-(3-pyridyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5Z)-5-[[2,5-dimethoxy-4-(1-pyrrolidinyl)phenyl]methylidene]-1-(3-pyridinyl)-1,3-diazinane-2,4,6-trione IUPAC Name: (5Z)-5-[(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)methylidene]-1-pyridin-3-yl-1,3-diazinane-2,4,6-trione Traditional Name: (5Z)-5-(2,5-dimethoxy-4-pyrrolidino-benzylidene)-1-(3-pyridyl)barbituric acid Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C2C(=O)NC(=O)N(C2=O)C3=CN=CC=C3)OC)N4CCCC4

Isomeric SMILES

COC1=CC(=C(C=C1/C=C\2/C(=O)NC(=O)N(C2=O)C3=CN=CC=C3)OC)N4CCCC4

InChI

InChI=1S/C22H22N4O5/c1-30-18-12-17(25-8-3-4-9-25)19(31-2)11-14(18)10-16-20(27)24-22(29)26(21(16)28)15-6-5-7-23-13-15/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,24,27,29)/b16-10-