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

Systemtic Name: 1-[4-methylidene-6-(2-propan-2-yloxyphenyl)-2-sulfanylidene-1,3-diazinan-5-yl]ethanone Openeye Name: 1-[4-(2-isopropoxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]ethanone CAS Name: 1-[4-methylene-6-(2-propan-2-yloxyphenyl)-2-sulfanylidene-1,3-diazinan-5-yl]ethanone IUPAC Name: 1-[4-methylidene-6-(2-propan-2-yloxyphenyl)-2-sulfanylidene-1,3-diazinan-5-yl]ethanone Traditional Name: 1-[4-(2-isopropoxyphenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]ethanone Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2C(C(=C)NC(=S)N2)C(=O)C

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2C(C(=C)NC(=S)N2)C(=O)C

InChI

InChI=1S/C16H20N2O2S/c1-9(2)20-13-8-6-5-7-12(13)15-14(11(4)19)10(3)17-16(21)18-15/h5-9,14-15H,3H2,1-2,4H3,(H2,17,18,21)