N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[[4-phenyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[[4-phenyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-phenyl-5-piperidino-1,2,4-triazol-3-yl)thio]acetamide Formula: C23H31N5OS MolecularWeight: 425.59014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCCC4=CCCCC4

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCCC4=CCCCC4

InChI

InChI=1S/C23H31N5OS/c29-21(24-15-14-19-10-4-1-5-11-19)18-30-23-26-25-22(27-16-8-3-9-17-27)28(23)20-12-6-2-7-13-20/h2,6-7,10,12-13H,1,3-5,8-9,11,14-18H2,(H,24,29)