[2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-5-[3-(trifluoromethyl)phenyl]sulfanyl-pyrrol-3-yl]methanol

Systemtic Name: [2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-5-[3-(trifluoromethyl)phenyl]sulfanyl-pyrrol-3-yl]methanol Openeye Name: [4-isopropyl-2-methyl-1-(4-pyridylmethyl)-5-[3-(trifluoromethyl)phenyl]sulfanyl-pyrrol-3-yl]methanol CAS Name: [2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-5-[[3-(trifluoromethyl)phenyl]thio]-3-pyrrolyl]methanol IUPAC Name: [2-methyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)-5-[3-(trifluoromethyl)phenyl]sulfanylpyrrol-3-yl]methanol Traditional Name: [4-isopropyl-2-methyl-1-(4-pyridylmethyl)-5-[[3-(trifluoromethyl)phenyl]thio]pyrrol-3-yl]methanol Formula: C22H23F3N2OS MolecularWeight: 420.49103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC=CC(=C3)C(F)(F)F)C(C)C)CO

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=NC=C2)SC3=CC=CC(=C3)C(F)(F)F)C(C)C)CO

InChI

InChI=1S/C22H23F3N2OS/c1-14(2)20-19(13-28)15(3)27(12-16-7-9-26-10-8-16)21(20)29-18-6-4-5-17(11-18)22(23,24)25/h4-11,14,28H,12-13H2,1-3H3