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

Systemtic Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-2-(2-phenylethenylsulfonyl)ethanone Openeye Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-1-piperidyl]-2-styrylsulfonyl-ethanone CAS Name: 1-[4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-2-(2-phenylethenylsulfonyl)ethanone IUPAC Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-2-(2-phenylethenylsulfonyl)ethanone Traditional Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidino]-2-styrylsulfonyl-ethanone Formula: C25H26N6O3S MolecularWeight: 490.57734

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CS(=O)(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CS(=O)(=O)C=CC5=CC=CC=C5

InChI

InChI=1S/C25H26N6O3S/c32-24(18-35(33,34)17-12-20-6-2-1-3-7-20)29-14-10-21(11-15-29)25-26-13-16-30(25)19-31-23-9-5-4-8-22(23)27-28-31/h1-9,12-13,16-17,21H,10-11,14-15,18-19H2