5-ethanoyl-3-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 5-ethanoyl-3-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 5-acetyl-3-(3-methoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one CAS Name: 5-acetyl-3-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 5-acetyl-3-(3-methoxyphenyl)-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 5-acetyl-3-(3-methoxyphenyl)-2-thioxo-hexahydropyrimidin-4-one Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CNC(=S)N(C1=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(=O)C1CNC(=S)N(C1=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C13H14N2O3S/c1-8(16)11-7-14-13(19)15(12(11)17)9-4-3-5-10(6-9)18-2/h3-6,11H,7H2,1-2H3,(H,14,19)