methyl (4R)-6-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-6-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-6-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxo-4-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-6-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-keto-4-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C16H17N5O3S2 MolecularWeight: 391.46788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CSC3=NN=C(S3)N)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2C(=C(NC(=O)N2)CSC3=NN=C(S3)N)C(=O)OC

InChI

InChI=1S/C16H17N5O3S2/c1-8-3-5-9(6-4-8)12-11(13(22)24-2)10(18-15(23)19-12)7-25-16-21-20-14(17)26-16/h3-6,12H,7H2,1-2H3,(H2,17,20)(H2,18,19,23)/t12-/m1/s1