ethyl 4-(3,4-dimethoxyphenyl)-6-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-6-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-6-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-6-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-6-(4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-(4-carbethoxy-3,5-dimethyl-1H-pyrrol-2-yl)-4-(3,4-dimethoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OC)OC)C3=C(C(=C(N3)C)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OC)OC)C3=C(C(=C(N3)C)C(=O)OCC)C

InChI

InChI=1S/C24H29N3O6S/c1-7-32-22(28)17-12(3)19(25-13(17)4)21-18(23(29)33-8-2)20(26-24(34)27-21)14-9-10-15(30-5)16(11-14)31-6/h9-11,20,25H,7-8H2,1-6H3,(H2,26,27,34)