1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-5-(1,2-dithiolan-3-yl)pentan-1-one

Systemtic Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-5-(1,2-dithiolan-3-yl)pentan-1-one Openeye Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-1-piperidyl]-5-(dithiolan-3-yl)pentan-1-one CAS Name: 1-[4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-5-(3-dithiolanyl)-1-pentanone IUPAC Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-5-(dithiolan-3-yl)pentan-1-one Traditional Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidino]-5-(dithiolan-3-yl)pentan-1-one Formula: C23H30N6OS2 MolecularWeight: 470.6539

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CCCCC5CCSS5

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CCCCC5CCSS5

InChI

InChI=1S/C23H30N6OS2/c30-22(8-4-1-5-19-11-16-31-32-19)27-13-9-18(10-14-27)23-24-12-15-28(23)17-29-21-7-3-2-6-20(21)25-26-29/h2-3,6-7,12,15,18-19H,1,4-5,8-11,13-14,16-17H2