2-[2-(3,5-dimethylphenyl)-3-[2-(4-pyridin-3-ylbutylamino)ethyl]-1H-indol-5-yl]-2-methyl-propanamide

Systemtic Name: 2-[2-(3,5-dimethylphenyl)-3-[2-(4-pyridin-3-ylbutylamino)ethyl]-1H-indol-5-yl]-2-methyl-propanamide Openeye Name: 2-[2-(3,5-dimethylphenyl)-3-[2-[4-(3-pyridyl)butylamino]ethyl]-1H-indol-5-yl]-2-methyl-propanamide CAS Name: 2-[2-(3,5-dimethylphenyl)-3-[2-[4-(3-pyridinyl)butylamino]ethyl]-1H-indol-5-yl]-2-methylpropanamide IUPAC Name: 2-[2-(3,5-dimethylphenyl)-3-[2-(4-pyridin-3-ylbutylamino)ethyl]-1H-indol-5-yl]-2-methylpropanamide Traditional Name: 2-[2-(3,5-dimethylphenyl)-3-[2-[4-(3-pyridyl)butylamino]ethyl]-1H-indol-5-yl]-2-methyl-propionamide Formula: C31H38N4O MolecularWeight: 482.65962

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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)N)CCNCCCCC4=CN=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N)CCNCCCCC4=CN=CC=C4)C

InChI

InChI=1S/C31H38N4O/c1-21-16-22(2)18-24(17-21)29-26(12-15-33-13-6-5-8-23-9-7-14-34-20-23)27-19-25(10-11-28(27)35-29)31(3,4)30(32)36/h7,9-11,14,16-20,33,35H,5-6,8,12-13,15H2,1-4H3,(H2,32,36)