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

Systemtic Name: (6S)-1-(1H-benzimidazol-2-yl)-6-(3-methylphenyl)-6,7-dihydro-5H-indazol-4-one Openeye Name: (6S)-1-(1H-benzimidazol-2-yl)-6-(m-tolyl)-6,7-dihydro-5H-indazol-4-one CAS Name: (6S)-1-(1H-benzimidazol-2-yl)-6-(3-methylphenyl)-6,7-dihydro-5H-indazol-4-one IUPAC Name: (6S)-1-(1H-benzimidazol-2-yl)-6-(3-methylphenyl)-6,7-dihydro-5H-indazol-4-one Traditional Name: (6S)-1-(1H-benzimidazol-2-yl)-6-(m-tolyl)-6,7-dihydro-5H-indazol-4-one Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CC3=C(C=NN3C4=NC5=CC=CC=C5N4)C(=O)C2

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2CC3=C(C=NN3C4=NC5=CC=CC=C5N4)C(=O)C2

InChI

InChI=1S/C21H18N4O/c1-13-5-4-6-14(9-13)15-10-19-16(20(26)11-15)12-22-25(19)21-23-17-7-2-3-8-18(17)24-21/h2-9,12,15H,10-11H2,1H3,(H,23,24)/t15-/m0/s1