1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-methylpropylamino)propan-2-yl]-1H-indol-5-yl]-2-methyl-propan-1-one

Systemtic Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-methylpropylamino)propan-2-yl]-1H-indol-5-yl]-2-methyl-propan-1-one Openeye Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(1S)-2-(isobutylamino)-1-methyl-ethyl]-1H-indol-5-yl]-2-methyl-propan-1-one CAS Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-methylpropylamino)propan-2-yl]-1H-indol-5-yl]-2-methyl-1-propanone IUPAC Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-methylpropylamino)propan-2-yl]-1H-indol-5-yl]-2-methylpropan-1-one Traditional Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(1S)-2-(isobutylamino)-1-methyl-ethyl]-1H-indol-5-yl]-2-methyl-propan-1-one Formula: C34H47N3O MolecularWeight: 513.75648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4CC5CCC4CC5)C(C)CNCC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4CC5CCC4CC5)[C@H](C)CNCC(C)C)C

InChI

InChI=1S/C34H47N3O/c1-21(2)18-35-19-24(5)31-29-17-27(34(6,7)33(38)37-20-25-8-11-28(37)12-9-25)10-13-30(29)36-32(31)26-15-22(3)14-23(4)16-26/h10,13-17,21,24-25,28,35-36H,8-9,11-12,18-20H2,1-7H3/t24-,25?,28?/m1/s1