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

Systemtic Name: 3-[(3,4-dimethylphenyl)amino]-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one Openeye Name: 3-(3,4-dimethylanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one CAS Name: 3-(3,4-dimethylanilino)-1-(4,6-dimethyl-2-pyrimidinyl)-6,6-dimethyl-5,7-dihydroindazol-4-one IUPAC Name: 3-(3,4-dimethylanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one Traditional Name: 3-(3,4-dimethylanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5O/c1-13-7-8-17(9-14(13)2)26-21-20-18(11-23(5,6)12-19(20)29)28(27-21)22-24-15(3)10-16(4)25-22/h7-10H,11-12H2,1-6H3,(H,26,27)