(1R,2R)-2-[(8-bromanyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)carbonyl]-N-(1-cyanocyclopropyl)cyclohexane-1-carboxamide

Systemtic Name: (1R,2R)-2-[(8-bromanyl-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)carbonyl]-N-(1-cyanocyclopropyl)cyclohexane-1-carboxamide Openeye Name: (1R,2R)-2-(8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)-N-(1-cyanocyclopropyl)cyclohexanecarboxamide CAS Name: (1R,2R)-2-[(8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-oxomethyl]-N-(1-cyanocyclopropyl)-1-cyclohexanecarboxamide IUPAC Name: (1R,2R)-2-(8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)-N-(1-cyanocyclopropyl)cyclohexane-1-carboxamide Traditional Name: (1R,2R)-2-(8-bromo-1,3,4,5-tetrahydropyrid[4,3-b]indole-2-carbonyl)-N-(1-cyanocyclopropyl)cyclohexanecarboxamide Formula: C23H25BrN4O2 MolecularWeight: 469.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2(CC2)C#N)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)Br

Isomeric SMILES

C1CC[C@H]([C@@H](C1)C(=O)NC2(CC2)C#N)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)Br

InChI

InChI=1S/C23H25BrN4O2/c24-14-5-6-19-17(11-14)18-12-28(10-7-20(18)26-19)22(30)16-4-2-1-3-15(16)21(29)27-23(13-25)8-9-23/h5-6,11,15-16,26H,1-4,7-10,12H2,(H,27,29)/t15-,16-/m1/s1