(6S)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-indazol-4-one

Systemtic Name: (6S)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-indazol-4-one Openeye Name: (6S)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-6-(p-tolyl)-6,7-dihydro-5H-indazol-4-one CAS Name: (6S)-1-(4,6-dimethyl-2-pyrimidinyl)-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-indazol-4-one IUPAC Name: (6S)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-indazol-4-one Traditional Name: (6S)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-6-(p-tolyl)-6,7-dihydro-5H-indazol-4-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC3=C(C(=NN3C4=NC(=CC(=N4)C)C)C)C(=O)C2

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2CC3=C(C(=NN3C4=NC(=CC(=N4)C)C)C)C(=O)C2

InChI

InChI=1S/C21H22N4O/c1-12-5-7-16(8-6-12)17-10-18-20(19(26)11-17)15(4)24-25(18)21-22-13(2)9-14(3)23-21/h5-9,17H,10-11H2,1-4H3/t17-/m0/s1