5-chloranyl-3-methyl-N-(4-piperazin-1-ylquinolin-6-yl)-1-benzofuran-2-sulfonamide

Systemtic Name: 5-chloranyl-3-methyl-N-(4-piperazin-1-ylquinolin-6-yl)-1-benzofuran-2-sulfonamide Openeye Name: 5-chloro-3-methyl-N-(4-piperazin-1-yl-6-quinolyl)benzofuran-2-sulfonamide CAS Name: 5-chloro-3-methyl-N-[4-(1-piperazinyl)-6-quinolinyl]-2-benzofuransulfonamide IUPAC Name: 5-chloro-3-methyl-N-(4-piperazin-1-ylquinolin-6-yl)-1-benzofuran-2-sulfonamide Traditional Name: 5-chloro-3-methyl-N-(4-piperazino-6-quinolyl)benzofuran-2-sulfonamide Formula: C22H21ClN4O3S MolecularWeight: 456.94514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC4=C(C=CN=C4C=C3)N5CCNCC5

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=CC4=C(C=CN=C4C=C3)N5CCNCC5

InChI

InChI=1S/C22H21ClN4O3S/c1-14-17-12-15(23)2-5-21(17)30-22(14)31(28,29)26-16-3-4-19-18(13-16)20(6-7-25-19)27-10-8-24-9-11-27/h2-7,12-13,24,26H,8-11H2,1H3