N-[2-[(1-cyano-4-oxidanyl-butyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide

Systemtic Name: N-[2-[(1-cyano-4-oxidanyl-butyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Openeye Name: N-[2-[(1-cyano-4-hydroxy-butyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide CAS Name: N-[2-[[(1-cyano-4-hydroxybutyl)amino]-oxomethyl]cyclohexyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-[(1-cyano-4-hydroxybutyl)carbamoyl]cyclohexyl]-1-methylindole-2-carboxamide Traditional Name: N-[2-[(1-cyano-4-hydroxy-butyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)NC3CCCCC3C(=O)NC(CCCO)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)NC3CCCCC3C(=O)NC(CCCO)C#N

InChI

InChI=1S/C22H28N4O3/c1-26-19-11-5-2-7-15(19)13-20(26)22(29)25-18-10-4-3-9-17(18)21(28)24-16(14-23)8-6-12-27/h2,5,7,11,13,16-18,27H,3-4,6,8-10,12H2,1H3,(H,24,28)(H,25,29)