N'-[2-[5-[1-(7-azabicyclo[2.2.1]heptan-7-yl)-2-methyl-1-oxidanylidene-propan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-N-cyano-3-pyridin-4-yl-pyrrolidine-1-carboximidamide

Systemtic Name: N'-[2-[5-[1-(7-azabicyclo[2.2.1]heptan-7-yl)-2-methyl-1-oxidanylidene-propan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-N-cyano-3-pyridin-4-yl-pyrrolidine-1-carboximidamide Openeye Name: N'-[2-[5-[2-(7-azabicyclo[2.2.1]heptan-7-yl)-1,1-dimethyl-2-oxo-ethyl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-N-cyano-3-(4-pyridyl)pyrrolidine-1-carboxamidine CAS Name: N'-[2-[5-[1-(7-azabicyclo[2.2.1]heptan-7-yl)-2-methyl-1-oxopropan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-N-cyano-3-pyridin-4-yl-1-pyrrolidinecarboximidamide IUPAC Name: N'-[2-[5-[1-(7-azabicyclo[2.2.1]heptan-7-yl)-2-methyl-1-oxopropan-2-yl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-N-cyano-3-pyridin-4-ylpyrrolidine-1-carboximidamide Traditional Name: N'-[2-[5-[2-(7-azabicyclo[2.2.1]heptan-7-yl)-2-keto-1,1-dimethyl-ethyl]-2-(3,5-dimethylphenyl)-1H-indol-3-yl]propyl]-N-cyano-3-(4-pyridyl)pyrrolidine-1-carboxamidine Formula: C40H47N7O MolecularWeight: 641.84748

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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)N4C5CCC4CC5)C(C)CN=C(NC#N)N6CCC(C6)C7=CC=NC=C7)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4C5CCC4CC5)C(C)CN=C(NC#N)N6CCC(C6)C7=CC=NC=C7)C

InChI

InChI=1S/C40H47N7O/c1-25-18-26(2)20-30(19-25)37-36(27(3)22-43-39(44-24-41)46-17-14-29(23-46)28-12-15-42-16-13-28)34-21-31(6-11-35(34)45-37)40(4,5)38(48)47-32-7-8-33(47)10-9-32/h6,11-13,15-16,18-21,27,29,32-33,45H,7-10,14,17,22-23H2,1-5H3,(H,43,44)