1-(4-fluorophenyl)-6-methyl-3-[(3-methylphenyl)amino]-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 1-(4-fluorophenyl)-6-methyl-3-[(3-methylphenyl)amino]-6,7-dihydro-5H-indazol-4-one Openeye Name: 1-(4-fluorophenyl)-6-methyl-3-(3-methylanilino)-6,7-dihydro-5H-indazol-4-one CAS Name: 1-(4-fluorophenyl)-6-methyl-3-(3-methylanilino)-6,7-dihydro-5H-indazol-4-one IUPAC Name: 1-(4-fluorophenyl)-6-methyl-3-(3-methylanilino)-6,7-dihydro-5H-indazol-4-one Traditional Name: 1-(4-fluorophenyl)-6-methyl-3-(m-toluidino)-6,7-dihydro-5H-indazol-4-one Formula: C21H20FN3O MolecularWeight: 349.401403

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=O)C1)C(=NN2C3=CC=C(C=C3)F)NC4=CC=CC(=C4)C

Isomeric SMILES

CC1CC2=C(C(=O)C1)C(=NN2C3=CC=C(C=C3)F)NC4=CC=CC(=C4)C

InChI

InChI=1S/C21H20FN3O/c1-13-4-3-5-16(10-13)23-21-20-18(11-14(2)12-19(20)26)25(24-21)17-8-6-15(22)7-9-17/h3-10,14H,11-12H2,1-2H3,(H,23,24)