3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6-thiophen-2-yl-4-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine

Systemtic Name: 3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6-thiophen-2-yl-4-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine Openeye Name: 3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6-(2-thienyl)-4-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine CAS Name: 3-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-6-thiophen-2-yl-4-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine IUPAC Name: 3-(2,5-dimethyl-1-phenylpyrrol-3-yl)-6-thiophen-2-yl-4-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine Traditional Name: 3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-6-(2-thienyl)-4-(trifluoromethyl)-1-[3-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine Formula: C30H20F6N4S MolecularWeight: 582.562019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C3=NN(C4=C3C(=CC(=N4)C5=CC=CS5)C(F)(F)F)C6=CC=CC(=C6)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C3=NN(C4=C3C(=CC(=N4)C5=CC=CS5)C(F)(F)F)C6=CC=CC(=C6)C(F)(F)F

InChI

InChI=1S/C30H20F6N4S/c1-17-14-22(18(2)39(17)20-9-4-3-5-10-20)27-26-23(30(34,35)36)16-24(25-12-7-13-41-25)37-28(26)40(38-27)21-11-6-8-19(15-21)29(31,32)33/h3-16H,1-2H3