(5E)-1-methyl-3-phenyl-5-[(4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: (5E)-1-methyl-3-phenyl-5-[(4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: (5E)-1-methyl-3-phenyl-5-[(4-pyrrolidin-1-ylphenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: (5E)-1-methyl-3-phenyl-5-[[4-(1-pyrrolidinyl)phenyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: (5E)-1-methyl-3-phenyl-5-[(4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: (5E)-1-methyl-3-phenyl-5-(4-pyrrolidinobenzylidene)barbituric acid Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(C=C2)N3CCCC3)C(=O)N(C1=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC=C(C=C2)N3CCCC3)/C(=O)N(C1=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3/c1-23-20(26)19(21(27)25(22(23)28)18-7-3-2-4-8-18)15-16-9-11-17(12-10-16)24-13-5-6-14-24/h2-4,7-12,15H,5-6,13-14H2,1H3/b19-15+