4-(2,3-dihydro-1-benzofuran-4-ylamino)-8-methyl-6-(4-methylphenyl)sulfonyl-quinoline-3-carboxamide

Systemtic Name: 4-(2,3-dihydro-1-benzofuran-4-ylamino)-8-methyl-6-(4-methylphenyl)sulfonyl-quinoline-3-carboxamide Openeye Name: 4-(2,3-dihydrobenzofuran-4-ylamino)-8-methyl-6-(p-tolylsulfonyl)quinoline-3-carboxamide CAS Name: 4-(2,3-dihydrobenzofuran-4-ylamino)-8-methyl-6-(4-methylphenyl)sulfonyl-3-quinolinecarboxamide IUPAC Name: 4-(2,3-dihydro-1-benzofuran-4-ylamino)-8-methyl-6-(4-methylphenyl)sulfonylquinoline-3-carboxamide Traditional Name: 4-(coumaran-4-ylamino)-8-methyl-6-tosyl-quinoline-3-carboxamide Formula: C26H23N3O4S MolecularWeight: 473.54352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=C3C(=C2)C(=C(C=N3)C(=O)N)NC4=C5CCOC5=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=C3C(=C2)C(=C(C=N3)C(=O)N)NC4=C5CCOC5=CC=C4)C

InChI

InChI=1S/C26H23N3O4S/c1-15-6-8-17(9-7-15)34(31,32)18-12-16(2)24-20(13-18)25(21(14-28-24)26(27)30)29-22-4-3-5-23-19(22)10-11-33-23/h3-9,12-14H,10-11H2,1-2H3,(H2,27,30)(H,28,29)