N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-piperidin-1-yl-phenyl)-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-N-[5-chloro-2-(1-piperidyl)phenyl]triazole-4-carboxamide CAS Name: N-[5-chloro-2-(1-piperidinyl)phenyl]-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-(5-chloro-2-piperidin-1-ylphenyl)triazole-4-carboxamide Traditional Name: 1-benzyl-N-(5-chloro-2-piperidino-phenyl)triazole-4-carboxamide Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN5O/c22-17-9-10-20(26-11-5-2-6-12-26)18(13-17)23-21(28)19-15-27(25-24-19)14-16-7-3-1-4-8-16/h1,3-4,7-10,13,15H,2,5-6,11-12,14H2,(H,23,28)