2-[2-(benzotriazol-1-yl)ethanoyl-(3-methoxyphenyl)amino]-N-(2-methylbutan-2-yl)-2-quinolin-6-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(3-methoxyphenyl)amino]-N-(2-methylbutan-2-yl)-2-quinolin-6-yl-ethanamide Openeye Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-3-methoxy-anilino)-N-(1,1-dimethylpropyl)-2-(6-quinolyl)acetamide CAS Name: 2-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-3-methoxyanilino)-N-(2-methylbutan-2-yl)-2-(6-quinolinyl)acetamide IUPAC Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-3-methoxyanilino)-N-(2-methylbutan-2-yl)-2-quinolin-6-ylacetamide Traditional Name: N-tert-amyl-2-(N-[2-(benzotriazol-1-yl)acetyl]-3-methoxy-anilino)-2-(6-quinolyl)acetamide Formula: C31H32N6O3 MolecularWeight: 536.62418

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

InChI

InChI=1S/C31H32N6O3/c1-5-31(2,3)33-30(39)29(22-15-16-25-21(18-22)10-9-17-32-25)37(23-11-8-12-24(19-23)40-4)28(38)20-36-27-14-7-6-13-26(27)34-35-36/h6-19,29H,5,20H2,1-4H3,(H,33,39)