5-(3-phenylsulfanylpropanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 5-(3-phenylsulfanylpropanoylamino)thiophene-2-carboxylic acid Openeye Name: 5-(3-phenylsulfanylpropanoylamino)thiophene-2-carboxylic acid CAS Name: 5-[[1-oxo-3-(phenylthio)propyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(3-phenylsulfanylpropanoylamino)thiophene-2-carboxylic acid Traditional Name: 5-[3-(phenylthio)propanoylamino]-2-thenoic acid Formula: C14H13NO3S2 MolecularWeight: 307.38792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C14H13NO3S2/c16-12(8-9-19-10-4-2-1-3-5-10)15-13-7-6-11(20-13)14(17)18/h1-7H,8-9H2,(H,15,16)(H,17,18)