2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(6-methoxypyridin-3-yl)-3-methyl-butanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(6-methoxypyridin-3-yl)-3-methyl-butanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(6-methoxy-3-pyridyl)-3-methyl-butanamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(6-methoxy-3-pyridinyl)-3-methylbutanamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(6-methoxypyridin-3-yl)-3-methylbutanamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(6-methoxy-3-pyridyl)-3-methyl-butyramide Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CN=C(C=C1)OC)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)C(C(=O)NC1=CN=C(C=C1)OC)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H25N3O6S/c1-13(2)19(20(24)22-14-5-8-18(27-3)21-12-14)23-30(25,26)15-6-7-16-17(11-15)29-10-4-9-28-16/h5-8,11-13,19,23H,4,9-10H2,1-3H3,(H,22,24)