2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methyl-N-(1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methyl-N-(1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methyl-N-(1,3,4-thiadiazol-2-yl)butanamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methyl-N-(1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methyl-N-(1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-3-methyl-N-(1,3,4-thiadiazol-2-yl)butyramide Formula: C16H20N4O5S2 MolecularWeight: 412.4838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NN=CS1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)C(C(=O)NC1=NN=CS1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H20N4O5S2/c1-10(2)14(15(21)18-16-19-17-9-26-16)20-27(22,23)11-4-5-12-13(8-11)25-7-3-6-24-12/h4-5,8-10,14,20H,3,6-7H2,1-2H3,(H,18,19,21)