1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-5-thiophen-2-yl-pentane-1,5-dione

Systemtic Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-5-thiophen-2-yl-pentane-1,5-dione Openeye Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-1-piperidyl]-5-(2-thienyl)pentane-1,5-dione CAS Name: 1-[4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-5-thiophen-2-ylpentane-1,5-dione IUPAC Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-5-thiophen-2-ylpentane-1,5-dione Traditional Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidino]-5-(2-thienyl)pentane-1,5-dione Formula: C24H26N6O2S MolecularWeight: 462.56724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CCCC(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CN3C4=CC=CC=C4N=N3)C(=O)CCCC(=O)C5=CC=CS5

InChI

InChI=1S/C24H26N6O2S/c31-21(22-8-4-16-33-22)7-3-9-23(32)28-13-10-18(11-14-28)24-25-12-15-29(24)17-30-20-6-2-1-5-19(20)26-27-30/h1-2,4-6,8,12,15-16,18H,3,7,9-11,13-14,17H2