2-[2-[[(4-fluorophenyl)methylamino]methyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[2-[[(4-fluorophenyl)methylamino]methyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carboxylic acid Openeye Name: 2-[2-[[(4-fluorophenyl)methylamino]methyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carboxylic acid CAS Name: 2-[2-[[(4-fluorophenyl)methylamino]methyl]-1-pyrrolyl]-4,5-dimethyl-3-thiophenecarboxylic acid IUPAC Name: 2-[2-[[(4-fluorophenyl)methylamino]methyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carboxylic acid Traditional Name: 2-[2-[[(4-fluorobenzyl)amino]methyl]pyrrol-1-yl]-4,5-dimethyl-3-thenoic acid Formula: C19H19FN2O2S MolecularWeight: 358.429763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)N2C=CC=C2CNCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)N2C=CC=C2CNCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C19H19FN2O2S/c1-12-13(2)25-18(17(12)19(23)24)22-9-3-4-16(22)11-21-10-14-5-7-15(20)8-6-14/h3-9,21H,10-11H2,1-2H3,(H,23,24)