3-[[2,4-bis(fluoranyl)phenyl]methyl-cyclobutylcarbonyl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[2,4-bis(fluoranyl)phenyl]methyl-cyclobutylcarbonyl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[cyclobutanecarbonyl-[(2,4-difluorophenyl)methyl]amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[cyclobutyl(oxo)methyl]-[(2,4-difluorophenyl)methyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[cyclobutanecarbonyl-[(2,4-difluorophenyl)methyl]amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[cyclobutanecarbonyl-(2,4-difluorobenzyl)amino]-5-phenyl-2-thenoic acid Formula: C23H19F2NO3S MolecularWeight: 427.463666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N(CC2=C(C=C(C=C2)F)F)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(C1)C(=O)N(CC2=C(C=C(C=C2)F)F)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H19F2NO3S/c24-17-10-9-16(18(25)11-17)13-26(22(27)15-7-4-8-15)19-12-20(30-21(19)23(28)29)14-5-2-1-3-6-14/h1-3,5-6,9-12,15H,4,7-8,13H2,(H,28,29)