propyl (4S)-4-(5-bromanylthiophen-2-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: propyl (4S)-4-(5-bromanylthiophen-2-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: propyl (4S)-4-(5-bromo-2-thienyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(5-bromo-2-thiophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propyl ester IUPAC Name: propyl (4S)-4-(5-bromothiophen-2-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(5-bromo-2-thienyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propyl ester Formula: C13H15BrN2O3S MolecularWeight: 359.2388

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(NC(=O)NC1C2=CC=C(S2)Br)C

Isomeric SMILES

CCCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=C(S2)Br)C

InChI

InChI=1S/C13H15BrN2O3S/c1-3-6-19-12(17)10-7(2)15-13(18)16-11(10)8-4-5-9(14)20-8/h4-5,11H,3,6H2,1-2H3,(H2,15,16,18)/t11-/m1/s1