ethyl (6S)-3-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-3-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-3-(4-ethoxyphenyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-3-(4-ethoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-4-methyl-3-p-phenetyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H22N2O3S2 MolecularWeight: 402.53028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=C(C(NC2=S)C3=CC=CS3)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=C([C@H](NC2=S)C3=CC=CS3)C(=O)OCC)C

InChI

InChI=1S/C20H22N2O3S2/c1-4-24-15-10-8-14(9-11-15)22-13(3)17(19(23)25-5-2)18(21-20(22)26)16-7-6-12-27-16/h6-12,18H,4-5H2,1-3H3,(H,21,26)/t18-/m1/s1