1-[4-(3,4-dimethoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone Openeye Name: 1-[4-(3,4-dimethoxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]ethanone CAS Name: 1-[4-(3,4-dimethoxyphenyl)-6-methylene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone IUPAC Name: 1-[4-(3,4-dimethoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone Traditional Name: 1-[4-(3,4-dimethoxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]ethanone Formula: C15H18N2O3S MolecularWeight: 306.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(NC(=S)NC1=C)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)C1C(NC(=S)NC1=C)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C15H18N2O3S/c1-8-13(9(2)18)14(17-15(21)16-8)10-5-6-11(19-3)12(7-10)20-4/h5-7,13-14H,1H2,2-4H3,(H2,16,17,21)