1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-3-(2,5-dimethylphenyl)prop-2-en-1-one

Systemtic Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-3-(2,5-dimethylphenyl)prop-2-en-1-one Openeye Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]-1-piperidyl]-3-(2,5-dimethylphenyl)prop-2-en-1-one CAS Name: 1-[4-[1-(1-benzotriazolylmethyl)-2-imidazolyl]-1-piperidinyl]-3-(2,5-dimethylphenyl)-2-propen-1-one IUPAC Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidin-1-yl]-3-(2,5-dimethylphenyl)prop-2-en-1-one Traditional Name: 1-[4-[1-(benzotriazol-1-ylmethyl)imidazol-2-yl]piperidino]-3-(2,5-dimethylphenyl)prop-2-en-1-one Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=CC(=O)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C=CC(=O)N2CCC(CC2)C3=NC=CN3CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C26H28N6O/c1-19-7-8-20(2)22(17-19)9-10-25(33)30-14-11-21(12-15-30)26-27-13-16-31(26)18-32-24-6-4-3-5-23(24)28-29-32/h3-10,13,16-17,21H,11-12,14-15,18H2,1-2H3