4-[5-chloranyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide

Systemtic Name: 4-[5-chloranyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Openeye Name: 4-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide CAS Name: 4-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Traditional Name: 4-(5-chloro-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4CC=C(CC4C3=O)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4CC=C(CC4C3=O)Cl)C

InChI

InChI=1S/C20H19ClN4O4S/c1-11-9-12(2)23-20(22-11)24-30(28,29)15-6-4-14(5-7-15)25-18(26)16-8-3-13(21)10-17(16)19(25)27/h3-7,9,16-17H,8,10H2,1-2H3,(H,22,23,24)