4-(4-ethylphenyl)-2-[2-(4-fluorophenyl)ethanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 4-(4-ethylphenyl)-2-[2-(4-fluorophenyl)ethanoylamino]thiophene-3-carboxylic acid Openeye Name: 4-(4-ethylphenyl)-2-[[2-(4-fluorophenyl)acetyl]amino]thiophene-3-carboxylic acid CAS Name: 4-(4-ethylphenyl)-2-[[2-(4-fluorophenyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(4-ethylphenyl)-2-[[2-(4-fluorophenyl)acetyl]amino]thiophene-3-carboxylic acid Traditional Name: 4-(4-ethylphenyl)-2-[[2-(4-fluorophenyl)acetyl]amino]-3-thenoic acid Formula: C21H18FNO3S MolecularWeight: 383.435923

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FNO3S/c1-2-13-3-7-15(8-4-13)17-12-27-20(19(17)21(25)26)23-18(24)11-14-5-9-16(22)10-6-14/h3-10,12H,2,11H2,1H3,(H,23,24)(H,25,26)