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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2C)O

Isomeric SMILES

CC(C(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC3=CC=CC=C3N2C)O

InChI

InChI=1S/C21H26N4O3/c1-13(26)17(12-22)24-20(27)15-8-4-5-9-16(15)23-21(28)19-11-14-7-3-6-10-18(14)25(19)2/h3,6-7,10-11,13,15-17,26H,4-5,8-9H2,1-2H3,(H,23,28)(H,24,27)