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

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(2-ethanoylphenyl)amino]-N-(2-methylbutan-2-yl)-2-quinolin-6-yl-ethanamide Openeye Name: 2-(2-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-(1,1-dimethylpropyl)-2-(6-quinolyl)acetamide CAS Name: 2-(2-acetyl-N-[2-(1-benzotriazolyl)-1-oxoethyl]anilino)-N-(2-methylbutan-2-yl)-2-(6-quinolinyl)acetamide IUPAC Name: 2-(2-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-(2-methylbutan-2-yl)-2-quinolin-6-ylacetamide Traditional Name: 2-(2-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-tert-amyl-2-(6-quinolyl)acetamide Formula: C32H32N6O3 MolecularWeight: 548.63488

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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(C3=CC=CC=C3C(=O)C)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC(C)(C)NC(=O)C(C1=CC2=C(C=C1)N=CC=C2)N(C3=CC=CC=C3C(=O)C)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C32H32N6O3/c1-5-32(3,4)34-31(41)30(23-16-17-25-22(19-23)11-10-18-33-25)38(27-14-8-6-12-24(27)21(2)39)29(40)20-37-28-15-9-7-13-26(28)35-36-37/h6-19,30H,5,20H2,1-4H3,(H,34,41)