4-(6-azanyl-5-bromanyl-pyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylic acid

Systemtic Name: 4-(6-azanyl-5-bromanyl-pyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophene-2-carboxylic acid Openeye Name: 4-[(6-amino-5-bromo-3-pyridyl)sulfonyl]-5-methylsulfanyl-thiophene-2-carboxylic acid CAS Name: 4-[(6-amino-5-bromo-3-pyridinyl)sulfonyl]-5-(methylthio)-2-thiophenecarboxylic acid IUPAC Name: 4-(6-amino-5-bromopyridin-3-yl)sulfonyl-5-methylsulfanylthiophene-2-carboxylic acid Traditional Name: 4-[(6-amino-5-bromo-3-pyridyl)sulfonyl]-5-(methylthio)-2-thenoic acid Formula: C11H9BrN2O4S3 MolecularWeight: 409.29916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=O)O)S(=O)(=O)C2=CC(=C(N=C2)N)Br

Isomeric SMILES

CSC1=C(C=C(S1)C(=O)O)S(=O)(=O)C2=CC(=C(N=C2)N)Br

InChI

InChI=1S/C11H9BrN2O4S3/c1-19-11-8(3-7(20-11)10(15)16)21(17,18)5-2-6(12)9(13)14-4-5/h2-4H,1H3,(H2,13,14)(H,15,16)