5-ethanoyl-1-methyl-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-ethanoyl-1-methyl-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-acetyl-1-methyl-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-acetyl-1-methyl-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-acetyl-1-methyl-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-acetyl-1-methyl-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)N(C(=S)N(C1=O)C2=CC=CC=C2)C

Isomeric SMILES

CC(=O)C1C(=O)N(C(=S)N(C1=O)C2=CC=CC=C2)C

InChI

InChI=1S/C13H12N2O3S/c1-8(16)10-11(17)14(2)13(19)15(12(10)18)9-6-4-3-5-7-9/h3-7,10H,1-2H3