N-[1-[2-(methylamino)-2-oxidanylidene-ethyl]piperidin-4-yl]-1-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[1-[2-(methylamino)-2-oxidanylidene-ethyl]piperidin-4-yl]-1-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[1-[2-(methylamino)-2-oxo-ethyl]-4-piperidyl]-1-phenyl-triazole-4-carboxamide CAS Name: N-[1-[2-(methylamino)-2-oxoethyl]-4-piperidinyl]-1-phenyl-4-triazolecarboxamide IUPAC Name: N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1-phenyltriazole-4-carboxamide Traditional Name: N-[1-[2-keto-2-(methylamino)ethyl]-4-piperidyl]-1-phenyl-triazole-4-carboxamide Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN1CCC(CC1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)CN1CCC(CC1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H22N6O2/c1-18-16(24)12-22-9-7-13(8-10-22)19-17(25)15-11-23(21-20-15)14-5-3-2-4-6-14/h2-6,11,13H,7-10,12H2,1H3,(H,18,24)(H,19,25)