1-(4-phenethylpiperidin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone

Systemtic Name: 1-(4-phenethylpiperidin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Openeye Name: 1-(4-phenethyl-1-piperidyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone CAS Name: 1-(4-phenethyl-1-piperidinyl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone IUPAC Name: 1-(4-phenethylpiperidin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Traditional Name: 1-(4-phenethylpiperidino)-2-(1H-1,2,4-triazol-5-ylthio)ethanone Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC2=CC=CC=C2)C(=O)CSC3=NC=NN3

Isomeric SMILES

C1CN(CCC1CCC2=CC=CC=C2)C(=O)CSC3=NC=NN3

InChI

InChI=1S/C17H22N4OS/c22-16(12-23-17-18-13-19-20-17)21-10-8-15(9-11-21)7-6-14-4-2-1-3-5-14/h1-5,13,15H,6-12H2,(H,18,19,20)