methyl 1-ethanoyl-6-(4-methoxyphenyl)-4-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 1-ethanoyl-6-(4-methoxyphenyl)-4-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 1-acetyl-6-(4-methoxyphenyl)-4-methylene-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: 1-acetyl-6-(4-methoxyphenyl)-4-methylene-2-sulfanylidene-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 1-acetyl-6-(4-methoxyphenyl)-4-methylidene-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: 1-acetyl-6-(4-methoxyphenyl)-4-methylene-2-thioxo-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C(C(=C)NC1=S)C(=O)OC)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)N1C(C(C(=C)NC1=S)C(=O)OC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H18N2O4S/c1-9-13(15(20)22-4)14(18(10(2)19)16(23)17-9)11-5-7-12(21-3)8-6-11/h5-8,13-14H,1H2,2-4H3,(H,17,23)