[2-(quinolin-2-ylsulfanylmethyl)-5-[4-(trifluoromethyl)phenyl]furan-3-yl]methanol

Systemtic Name: [2-(quinolin-2-ylsulfanylmethyl)-5-[4-(trifluoromethyl)phenyl]furan-3-yl]methanol Openeye Name: [2-(2-quinolylsulfanylmethyl)-5-[4-(trifluoromethyl)phenyl]-3-furyl]methanol CAS Name: [2-[(2-quinolinylthio)methyl]-5-[4-(trifluoromethyl)phenyl]-3-furanyl]methanol IUPAC Name: [2-(quinolin-2-ylsulfanylmethyl)-5-[4-(trifluoromethyl)phenyl]furan-3-yl]methanol Traditional Name: [2-[(2-quinolylthio)methyl]-5-[4-(trifluoromethyl)phenyl]-3-furyl]methanol Formula: C22H16F3NO2S MolecularWeight: 415.42815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCC3=C(C=C(O3)C4=CC=C(C=C4)C(F)(F)F)CO

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC3=C(C=C(O3)C4=CC=C(C=C4)C(F)(F)F)CO

InChI

InChI=1S/C22H16F3NO2S/c23-22(24,25)17-8-5-15(6-9-17)19-11-16(12-27)20(28-19)13-29-21-10-7-14-3-1-2-4-18(14)26-21/h1-11,27H,12-13H2