2-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-N-(2-ethylphenyl)ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

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