5-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-piperidin-1-ylethyl)pentanamide

Systemtic Name: 5-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-piperidin-1-ylethyl)pentanamide Openeye Name: 5-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(1-piperidyl)ethyl]pentanamide CAS Name: 5-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-[2-(1-piperidinyl)ethyl]pentanamide IUPAC Name: 5-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-piperidin-1-ylethyl)pentanamide Traditional Name: 5-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(2-piperidinoethyl)valeramide Formula: C26H33N5OS MolecularWeight: 463.63812

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)CCCCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCNC(=O)CCCCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H33N5OS/c32-24(27-17-20-30-18-9-3-10-19-30)16-8-11-21-33-26-29-28-25(22-12-4-1-5-13-22)31(26)23-14-6-2-7-15-23/h1-2,4-7,12-15H,3,8-11,16-21H2,(H,27,32)