N-[(4S)-1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-oxidanylidene-4-phenyl-butanamide

Systemtic Name: N-[(4S)-1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-oxidanylidene-4-phenyl-butanamide Openeye Name: N-[(4S)-1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-oxo-4-phenyl-butanamide CAS Name: N-[(4S)-1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-oxo-4-phenylbutanamide IUPAC Name: N-[(4S)-1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-oxo-4-phenylbutanamide Traditional Name: N-[(4S)-1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-4-keto-4-phenyl-butyramide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C3=C(C=N2)C(CCC3)NC(=O)CCC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C3=C(C=N2)[C@H](CCC3)NC(=O)CCC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H27N3O2/c1-17-13-18(2)15-20(14-17)28-23-10-6-9-22(21(23)16-26-28)27-25(30)12-11-24(29)19-7-4-3-5-8-19/h3-5,7-8,13-16,22H,6,9-12H2,1-2H3,(H,27,30)/t22-/m0/s1