4,5-dimethyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4,5-dimethyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylic acid Openeye Name: 4,5-dimethyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylic acid CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4,5-dimethyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylic acid Traditional Name: 4,5-dimethyl-2-[[2-(phenylthio)acetyl]amino]-3-thenoic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)CSC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)CSC2=CC=CC=C2)C

InChI

InChI=1S/C15H15NO3S2/c1-9-10(2)21-14(13(9)15(18)19)16-12(17)8-20-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,16,17)(H,18,19)