4-(2,5-dimethylpyrazol-3-yl)-2-[(3-fluorophenyl)carbonylamino]thiophene-3-carboxylic acid

Systemtic Name: 4-(2,5-dimethylpyrazol-3-yl)-2-[(3-fluorophenyl)carbonylamino]thiophene-3-carboxylic acid Openeye Name: 4-(2,5-dimethylpyrazol-3-yl)-2-[(3-fluorobenzoyl)amino]thiophene-3-carboxylic acid CAS Name: 4-(2,5-dimethyl-3-pyrazolyl)-2-[[(3-fluorophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(2,5-dimethylpyrazol-3-yl)-2-[(3-fluorobenzoyl)amino]thiophene-3-carboxylic acid Traditional Name: 4-(2,5-dimethylpyrazol-3-yl)-2-[(3-fluorobenzoyl)amino]-3-thenoic acid Formula: C17H14FN3O3S MolecularWeight: 359.374763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CSC(=C2C(=O)O)NC(=O)C3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=NN(C(=C1)C2=CSC(=C2C(=O)O)NC(=O)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C17H14FN3O3S/c1-9-6-13(21(2)20-9)12-8-25-16(14(12)17(23)24)19-15(22)10-4-3-5-11(18)7-10/h3-8H,1-2H3,(H,19,22)(H,23,24)