2-methoxyethyl (6S)-4-methyl-6-(2-methylphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6S)-4-methyl-6-(2-methylphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-4-methyl-6-(o-tolyl)-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-4-methyl-6-(2-methylphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-4-methyl-6-(2-methylphenyl)-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-4-methyl-6-(o-tolyl)-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(N(C(=S)N2)C3=CC=CC=C3)C)C(=O)OCCOC

Isomeric SMILES

CC1=CC=CC=C1[C@H]2C(=C(N(C(=S)N2)C3=CC=CC=C3)C)C(=O)OCCOC

InChI

InChI=1S/C22H24N2O3S/c1-15-9-7-8-12-18(15)20-19(21(25)27-14-13-26-3)16(2)24(22(28)23-20)17-10-5-4-6-11-17/h4-12,20H,13-14H2,1-3H3,(H,23,28)/t20-/m0/s1