2-[2-(benzotriazol-1-yl)ethanoyl-phenethyl-amino]-N-(2-methylbutan-2-yl)-2-quinolin-6-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-phenethyl-amino]-N-(2-methylbutan-2-yl)-2-quinolin-6-yl-ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-phenethyl-amino]-N-(1,1-dimethylpropyl)-2-(6-quinolyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-phenethylamino]-N-(2-methylbutan-2-yl)-2-(6-quinolinyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-phenethylamino]-N-(2-methylbutan-2-yl)-2-quinolin-6-ylacetamide Traditional Name: N-tert-amyl-2-[[2-(benzotriazol-1-yl)acetyl]-phenethyl-amino]-2-(6-quinolyl)acetamide Formula: C32H34N6O2 MolecularWeight: 534.65136

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(CCC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC(C)(C)NC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(CCC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C32H34N6O2/c1-4-32(2,3)34-31(40)30(25-16-17-26-24(21-25)13-10-19-33-26)37(20-18-23-11-6-5-7-12-23)29(39)22-38-28-15-9-8-14-27(28)35-36-38/h5-17,19,21,30H,4,18,20,22H2,1-3H3,(H,34,40)