4-[[[6,7-dimethoxy-2-(quinolin-6-ylamino)quinazolin-4-yl]amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[[6,7-dimethoxy-2-(quinolin-6-ylamino)quinazolin-4-yl]amino]methyl]benzenesulfonamide Openeye Name: 4-[[[6,7-dimethoxy-2-(6-quinolylamino)quinazolin-4-yl]amino]methyl]benzenesulfonamide CAS Name: 4-[[[6,7-dimethoxy-2-(6-quinolinylamino)-4-quinazolinyl]amino]methyl]benzenesulfonamide IUPAC Name: 4-[[[6,7-dimethoxy-2-(quinolin-6-ylamino)quinazolin-4-yl]amino]methyl]benzenesulfonamide Traditional Name: 4-[[[6,7-dimethoxy-2-(6-quinolylamino)quinazolin-4-yl]amino]methyl]benzenesulfonamide Formula: C26H24N6O4S MolecularWeight: 516.57156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NC3=CC4=C(C=C3)N=CC=C4)NCC5=CC=C(C=C5)S(=O)(=O)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NC3=CC4=C(C=C3)N=CC=C4)NCC5=CC=C(C=C5)S(=O)(=O)N)OC

InChI

InChI=1S/C26H24N6O4S/c1-35-23-13-20-22(14-24(23)36-2)31-26(30-18-7-10-21-17(12-18)4-3-11-28-21)32-25(20)29-15-16-5-8-19(9-6-16)37(27,33)34/h3-14H,15H2,1-2H3,(H2,27,33,34)(H2,29,30,31,32)