6,6-dimethyl-4-oxidanylidene-1-(4-propan-2-ylphenyl)-3-(thiophen-2-ylmethyl)-5,7-dihydroindazole-7-carbonitrile

Systemtic Name: 6,6-dimethyl-4-oxidanylidene-1-(4-propan-2-ylphenyl)-3-(thiophen-2-ylmethyl)-5,7-dihydroindazole-7-carbonitrile Openeye Name: 1-(4-isopropylphenyl)-6,6-dimethyl-4-oxo-3-(2-thienylmethyl)-5,7-dihydroindazole-7-carbonitrile CAS Name: 6,6-dimethyl-4-oxo-1-(4-propan-2-ylphenyl)-3-(thiophen-2-ylmethyl)-5,7-dihydroindazole-7-carbonitrile IUPAC Name: 6,6-dimethyl-4-oxo-1-(4-propan-2-ylphenyl)-3-(thiophen-2-ylmethyl)-5,7-dihydroindazole-7-carbonitrile Traditional Name: 4-keto-6,6-dimethyl-1-p-cumenyl-3-(2-thenyl)-5,7-dihydroindazole-7-carbonitrile Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)CC(C3C#N)(C)C)C(=N2)CC4=CC=CS4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)CC(C3C#N)(C)C)C(=N2)CC4=CC=CS4

InChI

InChI=1S/C24H25N3OS/c1-15(2)16-7-9-17(10-8-16)27-23-19(14-25)24(3,4)13-21(28)22(23)20(26-27)12-18-6-5-11-29-18/h5-11,15,19H,12-13H2,1-4H3