2-[[5-[(2-chloranylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[5-[(2-chloranylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1-piperidyl)ethanone CAS Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-piperidin-1-ylethanone Traditional Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-1-piperidino-ethanone Formula: C17H21ClN4O2S MolecularWeight: 380.89224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N2CCCCC2)COC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N2CCCCC2)COC3=CC=CC=C3Cl

InChI

InChI=1S/C17H21ClN4O2S/c1-21-15(11-24-14-8-4-3-7-13(14)18)19-20-17(21)25-12-16(23)22-9-5-2-6-10-22/h3-4,7-8H,2,5-6,9-12H2,1H3