2-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[4-[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]-1-piperazinyl]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazino]-N-(2,3-dimethylphenyl)acetamide Formula: C28H30N6O2 MolecularWeight: 482.5768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4)C

InChI

InChI=1S/C28H30N6O2/c1-20-6-5-8-24(21(20)2)29-27(35)19-32-14-16-33(17-15-32)28(36)23-12-10-22(11-13-23)18-34-26-9-4-3-7-25(26)30-31-34/h3-13H,14-19H2,1-2H3,(H,29,35)