2-methoxyethyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-(3-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-(3-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-(m-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-(1-imidazolyl)phenyl]-4-methyl-3-(3-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-(3-methylphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(4-imidazol-1-ylphenyl)-4-methyl-3-(m-tolyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(NC2=S)C3=CC=C(C=C3)N4C=CN=C4)C(=O)OCCOC)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C([C@H](NC2=S)C3=CC=C(C=C3)N4C=CN=C4)C(=O)OCCOC)C

InChI

InChI=1S/C25H26N4O3S/c1-17-5-4-6-21(15-17)29-18(2)22(24(30)32-14-13-31-3)23(27-25(29)33)19-7-9-20(10-8-19)28-12-11-26-16-28/h4-12,15-16,23H,13-14H2,1-3H3,(H,27,33)/t23-/m1/s1