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

Systemtic Name: 5-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[5-(p-tolylsulfanyl)-2-furyl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[5-[(4-methylphenyl)thio]-2-furanyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[5-(4-methylphenyl)sulfanylfuran-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[5-(p-tolylthio)-2-furyl]methylene]barbituric acid Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=C(O2)C=C3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C16H12N2O4S/c1-9-2-5-11(6-3-9)23-13-7-4-10(22-13)8-12-14(19)17-16(21)18-15(12)20/h2-8H,1H3,(H2,17,18,19,20,21)