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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1C)C)C2=CC(=CS2)Br)C(=O)OC

Isomeric SMILES

CC1=C(C(N(C(=O)N1C)C)C2=CC(=CS2)Br)C(=O)OC

InChI

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