N-(4-piperidin-1-ylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: N-(4-piperidin-1-ylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: N-[4-(1-piperidyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: N-[4-(1-piperidinyl)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: N-(4-piperidin-1-ylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: N-(4-piperidinophenyl)-2-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)SC3=NC=NN3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)SC3=NC=NN3

InChI

InChI=1S/C16H21N5OS/c1-12(23-16-17-11-18-20-16)15(22)19-13-5-7-14(8-6-13)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,22)(H,17,18,20)