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

Systemtic Name: N-[2-[(1-cyano-3-oxidanyl-propyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Openeye Name: N-[2-[(1-cyano-3-hydroxy-propyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide CAS Name: N-[2-[[(1-cyano-3-hydroxypropyl)amino]-oxomethyl]cyclohexyl]-1-methyl-2-indolecarboxamide IUPAC Name: N-[2-[(1-cyano-3-hydroxypropyl)carbamoyl]cyclohexyl]-1-methylindole-2-carboxamide Traditional Name: N-[2-[(1-cyano-3-hydroxy-propyl)carbamoyl]cyclohexyl]-1-methyl-indole-2-carboxamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c1-25-18-9-5-2-6-14(18)12-19(25)21(28)24-17-8-4-3-7-16(17)20(27)23-15(13-22)10-11-26/h2,5-6,9,12,15-17,26H,3-4,7-8,10-11H2,1H3,(H,23,27)(H,24,28)