5-ethyl-2-[2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 5-ethyl-2-[2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoylamino]thiophene-3-carboxylic acid Openeye Name: 5-ethyl-2-[[2-(2-oxo-1,3-benzothiazol-3-yl)acetyl]amino]thiophene-3-carboxylic acid CAS Name: 5-ethyl-2-[[1-oxo-2-(2-oxo-1,3-benzothiazol-3-yl)ethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-ethyl-2-[[2-(2-oxo-1,3-benzothiazol-3-yl)acetyl]amino]thiophene-3-carboxylic acid Traditional Name: 5-ethyl-2-[[2-(2-keto-1,3-benzothiazol-3-yl)acetyl]amino]-3-thenoic acid Formula: C16H14N2O4S2 MolecularWeight: 362.42336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2C3=CC=CC=C3SC2=O)C(=O)O

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2C3=CC=CC=C3SC2=O)C(=O)O

InChI

InChI=1S/C16H14N2O4S2/c1-2-9-7-10(15(20)21)14(23-9)17-13(19)8-18-11-5-3-4-6-12(11)24-16(18)22/h3-7H,2,8H2,1H3,(H,17,19)(H,20,21)