5-[[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[4-methoxy-3-[(2-pyridylthio)methyl]benzylidene]-1,3-dimethyl-barbituric acid Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C=C2)OC)CSC3=CC=CC=N3)C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=C(C=C2)OC)CSC3=CC=CC=N3)C(=O)N(C1=O)C

InChI

InChI=1S/C20H19N3O4S/c1-22-18(24)15(19(25)23(2)20(22)26)11-13-7-8-16(27-3)14(10-13)12-28-17-6-4-5-9-21-17/h4-11H,12H2,1-3H3