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

Systemtic Name: 4-(2,3-dihydro-1-benzofuran-4-ylamino)-6-[4-(dimethylamino)piperidin-1-yl]sulfonyl-quinoline-3-carboxamide Openeye Name: 4-(2,3-dihydrobenzofuran-4-ylamino)-6-[[4-(dimethylamino)-1-piperidyl]sulfonyl]quinoline-3-carboxamide CAS Name: 4-(2,3-dihydrobenzofuran-4-ylamino)-6-[[4-(dimethylamino)-1-piperidinyl]sulfonyl]-3-quinolinecarboxamide IUPAC Name: 4-(2,3-dihydro-1-benzofuran-4-ylamino)-6-[4-(dimethylamino)piperidin-1-yl]sulfonylquinoline-3-carboxamide Traditional Name: 4-(coumaran-4-ylamino)-6-[4-(dimethylamino)piperidino]sulfonyl-quinoline-3-carboxamide Formula: C25H29N5O4S MolecularWeight: 495.59386

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C(=CN=C3C=C2)C(=O)N)NC4=C5CCOC5=CC=C4

Isomeric SMILES

CN(C)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C(=CN=C3C=C2)C(=O)N)NC4=C5CCOC5=CC=C4

InChI

InChI=1S/C25H29N5O4S/c1-29(2)16-8-11-30(12-9-16)35(32,33)17-6-7-21-19(14-17)24(20(15-27-21)25(26)31)28-22-4-3-5-23-18(22)10-13-34-23/h3-7,14-16H,8-13H2,1-2H3,(H2,26,31)(H,27,28)