methyl (4R)-4-(4-methoxycarbonylphenyl)-6-propyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-4-(4-methoxycarbonylphenyl)-6-propyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-4-(4-methoxycarbonylphenyl)-6-propyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(4-methoxycarbonylphenyl)-6-propyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-(4-methoxycarbonylphenyl)-6-propyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(4-carbomethoxyphenyl)-6-propyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(NC(=S)N1)C2=CC=C(C=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCC1=C([C@H](NC(=S)N1)C2=CC=C(C=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H20N2O4S/c1-4-5-12-13(16(21)23-3)14(19-17(24)18-12)10-6-8-11(9-7-10)15(20)22-2/h6-9,14H,4-5H2,1-3H3,(H2,18,19,24)/t14-/m1/s1