6-bromanyl-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-dimethylaminoethyl)indole-2-carboxamide

Systemtic Name: 6-bromanyl-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-dimethylaminoethyl)indole-2-carboxamide Openeye Name: 6-bromo-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-dimethylaminoethyl)indole-2-carboxamide CAS Name: 6-bromo-N-[2-[(cyanomethylamino)-oxomethyl]cyclohexyl]-1-(2-dimethylaminoethyl)-2-indolecarboxamide IUPAC Name: 6-bromo-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-dimethylaminoethyl)indole-2-carboxamide Traditional Name: 6-bromo-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-dimethylaminoethyl)indole-2-carboxamide Formula: C22H28BrN5O2 MolecularWeight: 474.39402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=CC2=C1C=C(C=C2)Br)C(=O)NC3CCCCC3C(=O)NCC#N

Isomeric SMILES

CN(C)CCN1C(=CC2=C1C=C(C=C2)Br)C(=O)NC3CCCCC3C(=O)NCC#N

InChI

InChI=1S/C22H28BrN5O2/c1-27(2)11-12-28-19-14-16(23)8-7-15(19)13-20(28)22(30)26-18-6-4-3-5-17(18)21(29)25-10-9-24/h7-8,13-14,17-18H,3-6,10-12H2,1-2H3,(H,25,29)(H,26,30)