methyl 4-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 4-(4-ethoxyphenyl)-6-methyl-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-6-methyl-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: 4-methyl-6-p-phenetyl-2-thioxo-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(NC(=S)N2)C)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(NC(=S)N2)C)C(=O)OC

InChI

InChI=1S/C15H20N2O3S/c1-4-20-11-7-5-10(6-8-11)13-12(14(18)19-3)9(2)16-15(21)17-13/h5-9,12-13H,4H2,1-3H3,(H2,16,17,21)