1-(2-chlorophenyl)-5-[(2-methylsulfanylpyrimidin-5-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(2-chlorophenyl)-5-[(2-methylsulfanylpyrimidin-5-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-chlorophenyl)-5-[(2-methylsulfanylpyrimidin-5-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(2-chlorophenyl)-5-[[2-(methylthio)-5-pyrimidinyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(2-chlorophenyl)-5-[(2-methylsulfanylpyrimidin-5-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-chlorophenyl)-5-[[2-(methylthio)pyrimidin-5-yl]methylene]barbituric acid Formula: C16H11ClN4O3S MolecularWeight: 374.80154

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C=N1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3Cl

Isomeric SMILES

CSC1=NC=C(C=N1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H11ClN4O3S/c1-25-15-18-7-9(8-19-15)6-10-13(22)20-16(24)21(14(10)23)12-5-3-2-4-11(12)17/h2-8H,1H3,(H,20,22,24)