3-chloranyl-N-[4-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-5-phenyl-1,2,4-triazol-3-yl]phenyl]benzamide

Systemtic Name: 3-chloranyl-N-[4-[1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-5-phenyl-1,2,4-triazol-3-yl]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[1-[2-oxo-2-(1-piperidyl)ethyl]-5-phenyl-1,2,4-triazol-3-yl]phenyl]benzamide CAS Name: 3-chloro-N-[4-[1-[2-oxo-2-(1-piperidinyl)ethyl]-5-phenyl-1,2,4-triazol-3-yl]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[1-(2-oxo-2-piperidin-1-ylethyl)-5-phenyl-1,2,4-triazol-3-yl]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[1-(2-keto-2-piperidino-ethyl)-5-phenyl-1,2,4-triazol-3-yl]phenyl]benzamide Formula: C28H26ClN5O2 MolecularWeight: 499.99134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=NC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=NC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H26ClN5O2/c29-23-11-7-10-22(18-23)28(36)30-24-14-12-20(13-15-24)26-31-27(21-8-3-1-4-9-21)34(32-26)19-25(35)33-16-5-2-6-17-33/h1,3-4,7-15,18H,2,5-6,16-17,19H2,(H,30,36)