3-[2-[4-(phenylmethyl)piperidin-1-yl]ethylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[2-[4-(phenylmethyl)piperidin-1-yl]ethylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[2-(4-benzyl-1-piperidyl)ethylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[2-[4-(phenylmethyl)-1-piperidinyl]ethylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)ethylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[2-(4-benzylpiperidino)ethylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C16H23N5S MolecularWeight: 317.45232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCSC3=NNC(=N3)N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCSC3=NNC(=N3)N

InChI

InChI=1S/C16H23N5S/c17-15-18-16(20-19-15)22-11-10-21-8-6-14(7-9-21)12-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H3,17,18,19,20)