2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-phenylmethoxypiperidin-1-yl)ethanone

Systemtic Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-phenylmethoxypiperidin-1-yl)ethanone Openeye Name: 1-(4-benzyloxy-1-piperidyl)-2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]-1-(4-phenylmethoxy-1-piperidinyl)ethanone IUPAC Name: 2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-phenylmethoxypiperidin-1-yl)ethanone Traditional Name: 1-(4-benzoxypiperidino)-2-[[4-(2-ethylphenyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)N3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1N2C=NN=C2SCC(=O)N3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2S/c1-2-20-10-6-7-11-22(20)28-18-25-26-24(28)31-17-23(29)27-14-12-21(13-15-27)30-16-19-8-4-3-5-9-19/h3-11,18,21H,2,12-17H2,1H3