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

Systemtic Name: 8-methoxy-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole Openeye Name: 8-methoxy-1-(5-methylsulfonyl-2-pyridyl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole CAS Name: 8-methoxy-1-(5-methylsulfonyl-2-pyridinyl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole IUPAC Name: 8-methoxy-1-(5-methylsulfonylpyridin-2-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole Traditional Name: 1-(5-mesyl-2-pyridyl)-8-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(CCC3=C2N(N=C3C(F)(F)F)C4=NC=C(C=C4)S(=O)(=O)C)C=C1

Isomeric SMILES

COC1=CC2=C(CCC3=C2N(N=C3C(F)(F)F)C4=NC=C(C=C4)S(=O)(=O)C)C=C1

InChI

InChI=1S/C19H16F3N3O3S/c1-28-12-5-3-11-4-7-14-17(15(11)9-12)25(24-18(14)19(20,21)22)16-8-6-13(10-23-16)29(2,26)27/h3,5-6,8-10H,4,7H2,1-2H3