1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-2-(2-phenoxyethylsulfanyl)ethanone

Systemtic Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-2-(2-phenoxyethylsulfanyl)ethanone Openeye Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-1-piperidyl]-2-(2-phenoxyethylsulfanyl)ethanone CAS Name: 1-[4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-2-(2-phenoxyethylthio)ethanone IUPAC Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-2-(2-phenoxyethylsulfanyl)ethanone Traditional Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidino]-2-(2-phenoxyethylthio)ethanone Formula: C25H28N6O2S MolecularWeight: 476.59382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CSCCOC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CSCCOC5=CC=CC=C5

InChI

InChI=1S/C25H28N6O2S/c32-24(18-34-17-16-33-21-6-2-1-3-7-21)29-13-10-20(11-14-29)25-26-12-15-30(25)19-31-23-9-5-4-8-22(23)27-28-31/h1-9,12,15,20H,10-11,13-14,16-19H2