N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[2-(hydroxymethyl)-3-oxidanyl-propyl]indole-2-carboxamide

Systemtic Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[2-(hydroxymethyl)-3-oxidanyl-propyl]indole-2-carboxamide Openeye Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-[3-hydroxy-2-(hydroxymethyl)propyl]indole-2-carboxamide CAS Name: N-[2-[[(1-cyano-3-methylbutyl)amino]-oxomethyl]cyclohexyl]-1-[3-hydroxy-2-(hydroxymethyl)propyl]-2-indolecarboxamide IUPAC Name: N-[2-[(1-cyano-3-methylbutyl)carbamoyl]cyclohexyl]-1-[3-hydroxy-2-(hydroxymethyl)propyl]indole-2-carboxamide Traditional Name: N-[2-[(1-cyano-3-methyl-butyl)carbamoyl]cyclohexyl]-1-(3-hydroxy-2-methylol-propyl)indole-2-carboxamide Formula: C26H36N4O4 MolecularWeight: 468.58844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2CC(CO)CO

Isomeric SMILES

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2CC(CO)CO

InChI

InChI=1S/C26H36N4O4/c1-17(2)11-20(13-27)28-25(33)21-8-4-5-9-22(21)29-26(34)24-12-19-7-3-6-10-23(19)30(24)14-18(15-31)16-32/h3,6-7,10,12,17-18,20-22,31-32H,4-5,8-9,11,14-16H2,1-2H3,(H,28,33)(H,29,34)