N-[2-(1-azanylisoquinolin-7-yl)-5-(trifluoromethyl)pyrazol-3-yl]-5-(2-methylsulfonylphenyl)pyridine-2-carboxamide

Systemtic Name: N-[2-(1-azanylisoquinolin-7-yl)-5-(trifluoromethyl)pyrazol-3-yl]-5-(2-methylsulfonylphenyl)pyridine-2-carboxamide Openeye Name: N-[2-(1-amino-7-isoquinolyl)-5-(trifluoromethyl)pyrazol-3-yl]-5-(2-methylsulfonylphenyl)pyridine-2-carboxamide CAS Name: N-[2-(1-amino-7-isoquinolinyl)-5-(trifluoromethyl)-3-pyrazolyl]-5-(2-methylsulfonylphenyl)-2-pyridinecarboxamide IUPAC Name: N-[2-(1-aminoisoquinolin-7-yl)-5-(trifluoromethyl)pyrazol-3-yl]-5-(2-methylsulfonylphenyl)pyridine-2-carboxamide Traditional Name: N-[2-(1-amino-7-isoquinolyl)-5-(trifluoromethyl)pyrazol-3-yl]-5-(2-mesylphenyl)picolinamide Formula: C26H19F3N6O3S MolecularWeight: 552.52767

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CN=C(C=C2)C(=O)NC3=CC(=NN3C4=CC5=C(C=C4)C=CN=C5N)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CN=C(C=C2)C(=O)NC3=CC(=NN3C4=CC5=C(C=C4)C=CN=C5N)C(F)(F)F

InChI

InChI=1S/C26H19F3N6O3S/c1-39(37,38)21-5-3-2-4-18(21)16-7-9-20(32-14-16)25(36)33-23-13-22(26(27,28)29)34-35(23)17-8-6-15-10-11-31-24(30)19(15)12-17/h2-14H,1H3,(H2,30,31)(H,33,36)