5-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylamino]thiophene-2-carboxylic acid Openeye Name: 5-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]-2-furyl]methylamino]thiophene-2-carboxylic acid CAS Name: 5-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methylamino]-2-thiophenecarboxylic acid IUPAC Name: 5-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylamino]thiophene-2-carboxylic acid Traditional Name: 5-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]-2-furyl]methylamino]-2-thenoic acid Formula: C23H16F3NO3S MolecularWeight: 443.43825

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NCC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NCC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H16F3NO3S/c24-23(25,26)16-8-4-7-15(11-16)19-10-9-17(30-19)13-27-18-12-20(31-21(18)22(28)29)14-5-2-1-3-6-14/h1-12,27H,13H2,(H,28,29)