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

Systemtic Name: ethyl (6S)-3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-3-(4-chlorophenyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-(4-chlorophenyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C18H17ClN2O2S2 MolecularWeight: 392.92278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=CS2)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N[C@@H]1C2=CC=CS2)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H17ClN2O2S2/c1-3-23-17(22)15-11(2)21(13-8-6-12(19)7-9-13)18(24)20-16(15)14-5-4-10-25-14/h4-10,16H,3H2,1-2H3,(H,20,24)/t16-/m1/s1