5-methoxy-1-(4-methylphenyl)sulfonyl-2-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-one

Systemtic Name: 5-methoxy-1-(4-methylphenyl)sulfonyl-2-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-one Openeye Name: 5-methoxy-1-(p-tolylsulfonyl)-2-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-one CAS Name: 5-methoxy-1-(4-methylphenyl)sulfonyl-2-[[3-(trifluoromethyl)phenyl]methyl]-3-indazolone IUPAC Name: 5-methoxy-1-(4-methylphenyl)sulfonyl-2-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-one Traditional Name: 5-methoxy-1-tosyl-2-[3-(trifluoromethyl)benzyl]indazolin-3-one Formula: C23H19F3N2O4S MolecularWeight: 476.46817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)OC)C(=O)N2CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)OC)C(=O)N2CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H19F3N2O4S/c1-15-6-9-19(10-7-15)33(30,31)28-21-11-8-18(32-2)13-20(21)22(29)27(28)14-16-4-3-5-17(12-16)23(24,25)26/h3-13H,14H2,1-2H3