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4-(4-bromanylthiophen-2-yl)-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid

4-(4-bromanylthiophen-2-yl)-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid

Systemtic Name:4-(4-bromanylthiophen-2-yl)-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylic acid
Openeye Name:4-(4-bromo-2-thienyl)-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid
CAS Name:4-(4-bromo-2-thiophenyl)-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid
IUPAC Name:4-(4-bromothiophen-2-yl)-5-cyano-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid
Traditional Name:4-(4-bromo-2-thienyl)-5-cyano-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid
Formula: C11H8BrN3O3S
MolecularWeight: 342.16852
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)C(=O)O)C2=CC(=CS2)Br)C#N


Isomeric SMILES

CC1=C(C(N(C(=O)N1)C(=O)O)C2=CC(=CS2)Br)C#N


InChI

InChI=1S/C11H8BrN3O3S/c1-5-7(3-13)9(8-2-6(12)4-19-8)15(11(17)18)10(16)14-5/h2,4,9H,1H3,(H,14,16)(H,17,18)


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