ethyl (6R)-4-methyl-6-(1-methylpyrazol-4-yl)-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6R)-4-methyl-6-(1-methylpyrazol-4-yl)-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6R)-4-methyl-6-(1-methylpyrazol-4-yl)-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-4-methyl-6-(1-methyl-4-pyrazolyl)-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-4-methyl-6-(1-methylpyrazol-4-yl)-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-4-methyl-6-(1-methylpyrazol-4-yl)-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C15H22N4O2S MolecularWeight: 322.42578

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CN(N=C2)C)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=C([C@H](NC1=S)C2=CN(N=C2)C)C(=O)OCC)C

InChI

InChI=1S/C15H22N4O2S/c1-5-7-19-10(3)12(14(20)21-6-2)13(17-15(19)22)11-8-16-18(4)9-11/h8-9,13H,5-7H2,1-4H3,(H,17,22)/t13-/m1/s1