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

Systemtic Name: 2-(5-bromanylthiophen-2-yl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: 2-(5-bromo-2-thienyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(5-bromo-2-thiophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate IUPAC Name: 2-(5-bromothiophen-2-yl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 2-(5-bromo-2-thienyl)-4-keto-6-methyl-1H-pyrimidine-5-carboxylate Formula: C10H6BrN2O3S- MolecularWeight: 314.13524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC=C(S2)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC=C(S2)Br)C(=O)[O-]

InChI

InChI=1S/C10H7BrN2O3S/c1-4-7(10(15)16)9(14)13-8(12-4)5-2-3-6(11)17-5/h2-3H,1H3,(H,15,16)(H,12,13,14)/p-1