2-methoxyethyl 6-(4-methoxycarbonylphenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 6-(4-methoxycarbonylphenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 6-(4-methoxycarbonylphenyl)-4-methyl-3-phenethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-methoxycarbonylphenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 6-(4-methoxycarbonylphenyl)-4-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-carbomethoxyphenyl)-4-methyl-3-phenethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1CCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(NC(=S)N1CCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC)C(=O)OCCOC

InChI

InChI=1S/C25H28N2O5S/c1-17-21(24(29)32-16-15-30-2)22(19-9-11-20(12-10-19)23(28)31-3)26-25(33)27(17)14-13-18-7-5-4-6-8-18/h4-12,22H,13-16H2,1-3H3,(H,26,33)