1-(furan-2-ylmethyl)-5-[(2-methoxy-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(furan-2-ylmethyl)-5-[(2-methoxy-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-furylmethyl)-5-[(2-methoxy-4-pyrrolidin-1-yl-phenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-furanylmethyl)-5-[[2-methoxy-4-(1-pyrrolidinyl)phenyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(furan-2-ylmethyl)-5-[(2-methoxy-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-furfuryl)-5-(2-methoxy-4-pyrrolidino-benzylidene)barbituric acid Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCCC2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCCC2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4

InChI

InChI=1S/C21H21N3O5/c1-28-18-12-15(23-8-2-3-9-23)7-6-14(18)11-17-19(25)22-21(27)24(20(17)26)13-16-5-4-10-29-16/h4-7,10-12H,2-3,8-9,13H2,1H3,(H,22,25,27)