1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-3-[(4-methylphenyl)amino]-5,7-dihydroindazol-4-one

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-3-[(4-methylphenyl)amino]-5,7-dihydroindazol-4-one Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-3-(p-toluidino)-5,7-dihydroindazol-4-one Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=NC(=CC(=N4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=NC(=CC(=N4)C)C

InChI

InChI=1S/C22H25N5O/c1-13-6-8-16(9-7-13)25-20-19-17(11-22(4,5)12-18(19)28)27(26-20)21-23-14(2)10-15(3)24-21/h6-10H,11-12H2,1-5H3,(H,25,26)