6-methoxy-N-(1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]isoquinolin-3-amine

Systemtic Name: 6-methoxy-N-(1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]isoquinolin-3-amine Openeye Name: 6-methoxy-N-(1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]isoquinolin-3-amine CAS Name: 6-methoxy-N-(1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]-3-isoquinolinamine IUPAC Name: 6-methoxy-N-(1H-pyrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]isoquinolin-3-amine Traditional Name: [6-methoxy-1-[3-(trifluoromethyl)phenyl]-3-isoquinolyl]-(1H-pyrazol-5-yl)amine Formula: C20H15F3N4O MolecularWeight: 384.35451

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=NC(=C2C=C1)C3=CC(=CC=C3)C(F)(F)F)NC4=CC=NN4

Isomeric SMILES

COC1=CC2=CC(=NC(=C2C=C1)C3=CC(=CC=C3)C(F)(F)F)NC4=CC=NN4

InChI

InChI=1S/C20H15F3N4O/c1-28-15-5-6-16-13(10-15)11-18(25-17-7-8-24-27-17)26-19(16)12-3-2-4-14(9-12)20(21,22)23/h2-11H,1H3,(H2,24,25,26,27)