7-methoxy-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole

Systemtic Name: 7-methoxy-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole Openeye Name: 7-methoxy-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole CAS Name: 7-methoxy-1-(5-methylsulfonyl-2-pyridinyl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole IUPAC Name: 7-methoxy-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole Traditional Name: 1-(5-mesyl-2-pyridyl)-7-methoxy-3-(trifluoromethyl)-4,5-dihydrobenz[g]indazole Formula: C19H16F3N3O3S MolecularWeight: 423.40885

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)C(=NN3C4=NC=C(C=C4)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)C(=NN3C4=NC=C(C=C4)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O3S/c1-28-12-4-7-14-11(9-12)3-6-15-17(14)25(24-18(15)19(20,21)22)16-8-5-13(10-23-16)29(2,26)27/h4-5,7-10H,3,6H2,1-2H3