2-[4-(2-methylsulfonylbenzimidazol-1-yl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(2-methylsulfonylbenzimidazol-1-yl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(2-methylsulfonylbenzimidazol-1-yl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-(2-methylsulfonyl-1-benzimidazolyl)butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(2-methylsulfonylbenzimidazol-1-yl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-(2-mesylbenzimidazol-1-yl)butyl]isoindoline-1,3-quinone Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC2=CC=CC=C2N1CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)C1=NC2=CC=CC=C2N1CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H19N3O4S/c1-28(26,27)20-21-16-10-4-5-11-17(16)22(20)12-6-7-13-23-18(24)14-8-2-3-9-15(14)19(23)25/h2-5,8-11H,6-7,12-13H2,1H3