4-chloranyl-2,5-dimethyl-N-(7-piperazin-1-yl-2,3-dihydro-1-benzofuran-5-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-2,5-dimethyl-N-(7-piperazin-1-yl-2,3-dihydro-1-benzofuran-5-yl)benzenesulfonamide Openeye Name: 4-chloro-2,5-dimethyl-N-(7-piperazin-1-yl-2,3-dihydrobenzofuran-5-yl)benzenesulfonamide CAS Name: 4-chloro-2,5-dimethyl-N-[7-(1-piperazinyl)-2,3-dihydrobenzofuran-5-yl]benzenesulfonamide IUPAC Name: 4-chloro-2,5-dimethyl-N-(7-piperazin-1-yl-2,3-dihydro-1-benzofuran-5-yl)benzenesulfonamide Traditional Name: 4-chloro-2,5-dimethyl-N-(7-piperazinocoumaran-5-yl)benzenesulfonamide Formula: C20H24ClN3O3S MolecularWeight: 421.94086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=CC(=C3C(=C2)CCO3)N4CCNCC4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=CC(=C3C(=C2)CCO3)N4CCNCC4

InChI

InChI=1S/C20H24ClN3O3S/c1-13-10-19(14(2)9-17(13)21)28(25,26)23-16-11-15-3-8-27-20(15)18(12-16)24-6-4-22-5-7-24/h9-12,22-23H,3-8H2,1-2H3