1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylsulfonylbenzimidazol-1-yl)ethanone

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylsulfonylbenzimidazol-1-yl)ethanone Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylsulfonylbenzimidazol-1-yl)ethanone CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylsulfonyl-1-benzimidazolyl)ethanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylsulfonylbenzimidazol-1-yl)ethanone Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-mesylbenzimidazol-1-yl)ethanone Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC2=CC=CC=C2N1CC(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CS(=O)(=O)C1=NC2=CC=CC=C2N1CC(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H18N2O5S/c1-27(23,24)19-20-14-5-2-3-6-15(14)21(19)12-16(22)13-7-8-17-18(11-13)26-10-4-9-25-17/h2-3,5-8,11H,4,9-10,12H2,1H3