6-chloranyl-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-hydroxyethyl)indole-2-carboxamide

Systemtic Name: 6-chloranyl-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-hydroxyethyl)indole-2-carboxamide Openeye Name: 6-chloro-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-hydroxyethyl)indole-2-carboxamide CAS Name: 6-chloro-N-[2-[(cyanomethylamino)-oxomethyl]cyclohexyl]-1-(2-hydroxyethyl)-2-indolecarboxamide IUPAC Name: 6-chloro-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-hydroxyethyl)indole-2-carboxamide Traditional Name: 6-chloro-N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-(2-hydroxyethyl)indole-2-carboxamide Formula: C20H23ClN4O3 MolecularWeight: 402.87462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC#N)NC(=O)C2=CC3=C(N2CCO)C=C(C=C3)Cl

Isomeric SMILES

C1CCC(C(C1)C(=O)NCC#N)NC(=O)C2=CC3=C(N2CCO)C=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN4O3/c21-14-6-5-13-11-18(25(9-10-26)17(13)12-14)20(28)24-16-4-2-1-3-15(16)19(27)23-8-7-22/h5-6,11-12,15-16,26H,1-4,8-10H2,(H,23,27)(H,24,28)