ethyl 4-(4-bromanyl-5-methyl-thiophen-2-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN2O3S/c1-4-19-12(17)10-6(2)15-13(18)16-11(10)9-5-8(14)7(3)20-9/h5,11H,4H2,1-3H3,(H2,15,16,18)