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

Systemtic Name: methyl 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-(4-chlorophenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(4-chlorophenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C17H15ClN2O2S2 MolecularWeight: 378.8962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)Cl)C3=CSC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC=C(C=C2)Cl)C3=CSC=C3)C(=O)OC

InChI

InChI=1S/C17H15ClN2O2S2/c1-10-14(16(21)22-2)15(11-7-8-24-9-11)19-17(23)20(10)13-5-3-12(18)4-6-13/h3-9,15H,1-2H3,(H,19,23)