2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenethylpiperidin-1-yl)ethanone

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenethylpiperidin-1-yl)ethanone Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenethyl-1-piperidyl)ethanone CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-(4-phenethyl-1-piperidinyl)ethanone IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenethylpiperidin-1-yl)ethanone Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1-(4-phenethylpiperidino)ethanone Formula: C23H30N4OS MolecularWeight: 410.5755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC(=O)N4CCC(CC4)CCC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC(=O)N4CCC(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C23H30N4OS/c28-21(16-29-23-25-24-22(19-8-9-19)27(23)20-10-11-20)26-14-12-18(13-15-26)7-6-17-4-2-1-3-5-17/h1-5,18-20H,6-16H2