3-[[4-methyl-7-(5-methylpyrazin-2-yl)-1-(trifluoromethyl)isoquinolin-3-yl]amino]phenol

Systemtic Name: 3-[[4-methyl-7-(5-methylpyrazin-2-yl)-1-(trifluoromethyl)isoquinolin-3-yl]amino]phenol Openeye Name: 3-[[4-methyl-7-(5-methylpyrazin-2-yl)-1-(trifluoromethyl)-3-isoquinolyl]amino]phenol CAS Name: 3-[[4-methyl-7-(5-methyl-2-pyrazinyl)-1-(trifluoromethyl)-3-isoquinolinyl]amino]phenol IUPAC Name: 3-[[4-methyl-7-(5-methylpyrazin-2-yl)-1-(trifluoromethyl)isoquinolin-3-yl]amino]phenol Traditional Name: 3-[[4-methyl-7-(5-methylpyrazin-2-yl)-1-(trifluoromethyl)-3-isoquinolyl]amino]phenol Formula: C22H17F3N4O MolecularWeight: 410.39179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C2=CC3=C(C=C2)C(=C(N=C3C(F)(F)F)NC4=CC(=CC=C4)O)C

Isomeric SMILES

CC1=NC=C(N=C1)C2=CC3=C(C=C2)C(=C(N=C3C(F)(F)F)NC4=CC(=CC=C4)O)C

InChI

InChI=1S/C22H17F3N4O/c1-12-10-27-19(11-26-12)14-6-7-17-13(2)21(28-15-4-3-5-16(30)9-15)29-20(18(17)8-14)22(23,24)25/h3-11,30H,1-2H3,(H,28,29)