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

Systemtic Name: N-[(4S)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-3-methylsulfanyl-propanamide Openeye Name: N-[(4S)-6,6-dimethyl-1-(o-tolyl)-5,7-dihydro-4H-indazol-4-yl]-3-methylsulfanyl-propanamide CAS Name: N-[(4S)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-3-(methylthio)propanamide IUPAC Name: N-[(4S)-6,6-dimethyl-1-(2-methylphenyl)-5,7-dihydro-4H-indazol-4-yl]-3-methylsulfanylpropanamide Traditional Name: N-[(4S)-6,6-dimethyl-1-(o-tolyl)-5,7-dihydro-4H-indazol-4-yl]-3-(methylthio)propionamide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=N2)[C@H](CC(C3)(C)C)NC(=O)CCSC

InChI

InChI=1S/C20H27N3OS/c1-14-7-5-6-8-17(14)23-18-12-20(2,3)11-16(15(18)13-21-23)22-19(24)9-10-25-4/h5-8,13,16H,9-12H2,1-4H3,(H,22,24)/t16-/m0/s1