4-(2,3-dihydro-1-benzofuran-4-ylamino)-6-[4-(dimethylcarbamoyl)piperazin-1-yl]sulfonyl-quinoline-3-carboxamide

Systemtic Name: 4-(2,3-dihydro-1-benzofuran-4-ylamino)-6-[4-(dimethylcarbamoyl)piperazin-1-yl]sulfonyl-quinoline-3-carboxamide Openeye Name: 4-(2,3-dihydrobenzofuran-4-ylamino)-6-[4-(dimethylcarbamoyl)piperazin-1-yl]sulfonyl-quinoline-3-carboxamide CAS Name: 4-(2,3-dihydrobenzofuran-4-ylamino)-6-[[4-[dimethylamino(oxo)methyl]-1-piperazinyl]sulfonyl]-3-quinolinecarboxamide IUPAC Name: 4-(2,3-dihydro-1-benzofuran-4-ylamino)-6-[4-(dimethylcarbamoyl)piperazin-1-yl]sulfonylquinoline-3-carboxamide Traditional Name: 4-(coumaran-4-ylamino)-6-[4-(dimethylcarbamoyl)piperazino]sulfonyl-quinoline-3-carboxamide Formula: C25H28N6O5S MolecularWeight: 524.59202

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C(=CN=C3C=C2)C(=O)N)NC4=C5CCOC5=CC=C4

Isomeric SMILES

CN(C)C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(C(=CN=C3C=C2)C(=O)N)NC4=C5CCOC5=CC=C4

InChI

InChI=1S/C25H28N6O5S/c1-29(2)25(33)30-9-11-31(12-10-30)37(34,35)16-6-7-20-18(14-16)23(19(15-27-20)24(26)32)28-21-4-3-5-22-17(21)8-13-36-22/h3-7,14-15H,8-13H2,1-2H3,(H2,26,32)(H,27,28)