1-(6-methylsulfonylpyridin-3-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole

Systemtic Name: 1-(6-methylsulfonylpyridin-3-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole Openeye Name: 1-(6-methylsulfonyl-3-pyridyl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole CAS Name: 1-(6-methylsulfonyl-3-pyridinyl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole IUPAC Name: 1-(6-methylsulfonylpyridin-3-yl)-3-(trifluoromethyl)-4,5-dihydrobenzo[g]indazole Traditional Name: 1-(6-mesyl-3-pyridyl)-3-(trifluoromethyl)-4,5-dihydrobenz[g]indazole Formula: C18H14F3N3O2S MolecularWeight: 393.38287

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C=C1)N2C3=C(CCC4=CC=CC=C43)C(=N2)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C=C1)N2C3=C(CCC4=CC=CC=C43)C(=N2)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2S/c1-27(25,26)15-9-7-12(10-22-15)24-16-13-5-3-2-4-11(13)6-8-14(16)17(23-24)18(19,20)21/h2-5,7,9-10H,6,8H2,1H3