N-(3-chloranyl-4-methoxy-phenyl)-2-methyl-5-(4-oxidanylidene-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-methyl-5-(4-oxidanylidene-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-methyl-5-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-methyl-5-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-methyl-5-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-5-(4-keto-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)-2-methyl-benzenesulfonamide Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C3=C2CCCC3)S(=O)(=O)NC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C3=C2CCCC3)S(=O)(=O)NC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C22H22ClN3O4S/c1-13-7-8-14(21-16-5-3-4-6-17(16)22(27)25-24-21)11-20(13)31(28,29)26-15-9-10-19(30-2)18(23)12-15/h7-12,26H,3-6H2,1-2H3,(H,25,27)