N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]indole-2-carboxamide

Systemtic Name: N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]indole-2-carboxamide Openeye Name: N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-[[1-(2-methoxyethyl)-4-piperidyl]methyl]indole-2-carboxamide CAS Name: N-[2-[(cyanomethylamino)-oxomethyl]cyclohexyl]-1-[[1-(2-methoxyethyl)-4-piperidinyl]methyl]-2-indolecarboxamide IUPAC Name: N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]indole-2-carboxamide Traditional Name: N-[2-(cyanomethylcarbamoyl)cyclohexyl]-1-[[1-(2-methoxyethyl)-4-piperidyl]methyl]indole-2-carboxamide Formula: C27H37N5O3 MolecularWeight: 479.61438

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCC(CC1)CN2C3=CC=CC=C3C=C2C(=O)NC4CCCCC4C(=O)NCC#N

Isomeric SMILES

COCCN1CCC(CC1)CN2C3=CC=CC=C3C=C2C(=O)NC4CCCCC4C(=O)NCC#N

InChI

InChI=1S/C27H37N5O3/c1-35-17-16-31-14-10-20(11-15-31)19-32-24-9-5-2-6-21(24)18-25(32)27(34)30-23-8-4-3-7-22(23)26(33)29-13-12-28/h2,5-6,9,18,20,22-23H,3-4,7-8,10-11,13-17,19H2,1H3,(H,29,33)(H,30,34)