3-acetamido-N-[6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]propanamide

Systemtic Name: 3-acetamido-N-[6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]propanamide Openeye Name: 3-acetamido-N-[6,6-dimethyl-1-(o-tolyl)-5,7-dihydro-4H-indazol-4-yl]propanamide CAS Name: 3-acetamido-N-[6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]propanamide IUPAC Name: 3-acetamido-N-[6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]propanamide Traditional Name: 3-acetamido-N-[6,6-dimethyl-1-(o-tolyl)-5,7-dihydro-4H-indazol-4-yl]propionamide Formula: C21H28N4O2 MolecularWeight: 368.47262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=N2)C(CC(C3)(C)C)NC(=O)CCNC(=O)C

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=N2)C(CC(C3)(C)C)NC(=O)CCNC(=O)C

InChI

InChI=1S/C21H28N4O2/c1-14-7-5-6-8-18(14)25-19-12-21(3,4)11-17(16(19)13-23-25)24-20(27)9-10-22-15(2)26/h5-8,13,17H,9-12H2,1-4H3,(H,22,26)(H,24,27)