methyl (4S)-4-(4-methoxyphenyl)-6-[(4-methoxyphenyl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-4-(4-methoxyphenyl)-6-[(4-methoxyphenyl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-4-(4-methoxyphenyl)-6-[(4-methoxyphenyl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-methoxyphenyl)-6-[[(4-methoxyphenyl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(4-methoxyphenyl)-6-[(4-methoxyphenyl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-4-(4-methoxyphenyl)-6-[[(4-methoxyphenyl)thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CSC3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2C(=C(NC(=O)N2)CSC3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C21H22N2O5S/c1-26-14-6-4-13(5-7-14)19-18(20(24)28-3)17(22-21(25)23-19)12-29-16-10-8-15(27-2)9-11-16/h4-11,19H,12H2,1-3H3,(H2,22,23,25)/t19-/m0/s1