5-methylsulfanyl-3-(4-pyridin-3-ylphenyl)thiophene-2-carboxylic acid

Systemtic Name: 5-methylsulfanyl-3-(4-pyridin-3-ylphenyl)thiophene-2-carboxylic acid Openeye Name: 5-methylsulfanyl-3-[4-(3-pyridyl)phenyl]thiophene-2-carboxylic acid CAS Name: 5-(methylthio)-3-[4-(3-pyridinyl)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 5-methylsulfanyl-3-(4-pyridin-3-ylphenyl)thiophene-2-carboxylic acid Traditional Name: 5-(methylthio)-3-[4-(3-pyridyl)phenyl]-2-thenoic acid Formula: C17H13NO2S2 MolecularWeight: 327.42062

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(S1)C(=O)O)C2=CC=C(C=C2)C3=CN=CC=C3

Isomeric SMILES

CSC1=CC(=C(S1)C(=O)O)C2=CC=C(C=C2)C3=CN=CC=C3

InChI

InChI=1S/C17H13NO2S2/c1-21-15-9-14(16(22-15)17(19)20)12-6-4-11(5-7-12)13-3-2-8-18-10-13/h2-10H,1H3,(H,19,20)