N1,N1-diethyl-N4-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-1,4-dicarboxamide

Systemtic Name: N1,N1-diethyl-N4-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-1,4-dicarboxamide Openeye Name: N1,N1-diethyl-N4-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-1,4-dicarboxamide CAS Name: N1,N1-diethyl-N4-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-1,4-dicarboxamide IUPAC Name: 1-N,1-N-diethyl-4-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-1,4-dicarboxamide Traditional Name: N,N-diethyl-N'-[2-(1,2,4-triazol-1-ylmethyl)benzyl]piperidine-1,4-dicarboxamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCC(CC1)C(=O)NCC2=CC=CC=C2CN3C=NC=N3

Isomeric SMILES

CCN(CC)C(=O)N1CCC(CC1)C(=O)NCC2=CC=CC=C2CN3C=NC=N3

InChI

InChI=1S/C21H30N6O2/c1-3-25(4-2)21(29)26-11-9-17(10-12-26)20(28)23-13-18-7-5-6-8-19(18)14-27-16-22-15-24-27/h5-8,15-17H,3-4,9-14H2,1-2H3,(H,23,28)