1-(azocan-1-yl)-2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(azocan-1-yl)-2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(azocan-1-yl)-2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(1-azocanyl)-2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(azocan-1-yl)-2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(azocan-1-yl)-2-[[5-(cyclopentylmethyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C17H28N4OS MolecularWeight: 336.49542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)CSC2=NNC(=N2)CC3CCCC3

Isomeric SMILES

C1CCCN(CCC1)C(=O)CSC2=NNC(=N2)CC3CCCC3

InChI

InChI=1S/C17H28N4OS/c22-16(21-10-6-2-1-3-7-11-21)13-23-17-18-15(19-20-17)12-14-8-4-5-9-14/h14H,1-13H2,(H,18,19,20)