3-[[1-(4-fluorophenyl)-2-methyl-1-oxidanylidene-propan-2-yl]amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[1-(4-fluorophenyl)-2-methyl-1-oxidanylidene-propan-2-yl]amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[[2-(4-fluorophenyl)-1,1-dimethyl-2-oxo-ethyl]amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[1-(4-fluorophenyl)-2-methyl-1-oxopropan-2-yl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[[1-(4-fluorophenyl)-2-methyl-1-oxopropan-2-yl]amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[[2-(4-fluorophenyl)-2-keto-1,1-dimethyl-ethyl]amino]-5-phenyl-2-thenoic acid Formula: C21H18FNO3S MolecularWeight: 383.435923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC=C(C=C1)F)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C(=O)C1=CC=C(C=C1)F)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

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