N-[2-[(1-cyano-2-phenyl-ethyl)carbamoyl]cyclohexyl]-1-methyl-6-oxidanyl-indole-2-carboxamide

Systemtic Name: N-[2-[(1-cyano-2-phenyl-ethyl)carbamoyl]cyclohexyl]-1-methyl-6-oxidanyl-indole-2-carboxamide Openeye Name: N-[2-[(1-cyano-2-phenyl-ethyl)carbamoyl]cyclohexyl]-6-hydroxy-1-methyl-indole-2-carboxamide CAS Name: N-[2-[[(1-cyano-2-phenylethyl)amino]-oxomethyl]cyclohexyl]-6-hydroxy-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-[(1-cyano-2-phenylethyl)carbamoyl]cyclohexyl]-6-hydroxy-1-methylindole-2-carboxamide Traditional Name: N-[2-[(1-cyano-2-phenyl-ethyl)carbamoyl]cyclohexyl]-6-hydroxy-1-methyl-indole-2-carboxamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C=C(C=C2)O)C(=O)NC3CCCCC3C(=O)NC(CC4=CC=CC=C4)C#N

Isomeric SMILES

CN1C(=CC2=C1C=C(C=C2)O)C(=O)NC3CCCCC3C(=O)NC(CC4=CC=CC=C4)C#N

InChI

InChI=1S/C26H28N4O3/c1-30-23-15-20(31)12-11-18(23)14-24(30)26(33)29-22-10-6-5-9-21(22)25(32)28-19(16-27)13-17-7-3-2-4-8-17/h2-4,7-8,11-12,14-15,19,21-22,31H,5-6,9-10,13H2,1H3,(H,28,32)(H,29,33)