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

Systemtic Name: 3-[(2-chloranyl-4-methyl-phenyl)amino]-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one Openeye Name: 3-(2-chloro-4-methyl-anilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one CAS Name: 3-(2-chloro-4-methylanilino)-1-(4,6-dimethyl-2-pyrimidinyl)-6,6-dimethyl-5,7-dihydroindazol-4-one IUPAC Name: 3-(2-chloro-4-methylanilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one Traditional Name: 3-(2-chloro-4-methyl-anilino)-1-(4,6-dimethylpyrimidin-2-yl)-6,6-dimethyl-5,7-dihydroindazol-4-one Formula: C22H24ClN5O MolecularWeight: 409.91186

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN5O/c1-12-6-7-16(15(23)8-12)26-20-19-17(10-22(4,5)11-18(19)29)28(27-20)21-24-13(2)9-14(3)25-21/h6-9H,10-11H2,1-5H3,(H,26,27)