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

Systemtic Name: 1-(1H-benzimidazol-2-yl)-6,6-dimethyl-3-[(4-methylphenyl)amino]-5,7-dihydroindazol-4-one Openeye Name: 1-(1H-benzimidazol-2-yl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one CAS Name: 1-(1H-benzimidazol-2-yl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one IUPAC Name: 1-(1H-benzimidazol-2-yl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one Traditional Name: 1-(1H-benzimidazol-2-yl)-6,6-dimethyl-3-(p-toluidino)-5,7-dihydroindazol-4-one Formula: C23H23N5O MolecularWeight: 385.46162

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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=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H23N5O/c1-14-8-10-15(11-9-14)24-21-20-18(12-23(2,3)13-19(20)29)28(27-21)22-25-16-6-4-5-7-17(16)26-22/h4-11H,12-13H2,1-3H3,(H,24,27)(H,25,26)