3-methyl-5-(2-pyridin-4-ylsulfanylethanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-(2-pyridin-4-ylsulfanylethanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[[2-(4-pyridylsulfanyl)acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[(2-pyridin-4-ylsulfanylacetyl)amino]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[[2-(4-pyridylthio)acetyl]amino]-2-thenoic acid Formula: C13H12N2O3S2 MolecularWeight: 308.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CSC2=CC=NC=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CSC2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C13H12N2O3S2/c1-8-6-11(20-12(8)13(17)18)15-10(16)7-19-9-2-4-14-5-3-9/h2-6H,7H2,1H3,(H,15,16)(H,17,18)