1-(cyclohexylmethyl)-6-oxidanylidene-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-(cyclohexylmethyl)-6-oxidanylidene-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(cyclohexylmethyl)-6-oxo-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-(cyclohexylmethyl)-6-oxo-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(cyclohexylmethyl)-6-oxo-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(cyclohexylmethyl)-6-keto-N-[4-(1,2,4-triazol-1-yl)benzyl]nipecotamide Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CC(CCC2=O)C(=O)NCC3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1CCC(CC1)CN2CC(CCC2=O)C(=O)NCC3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C22H29N5O2/c28-21-11-8-19(14-26(21)13-18-4-2-1-3-5-18)22(29)24-12-17-6-9-20(10-7-17)27-16-23-15-25-27/h6-7,9-10,15-16,18-19H,1-5,8,11-14H2,(H,24,29)