2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3-methyl-butyramide Formula: C21H23N3O7S3 MolecularWeight: 525.61822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)C(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23N3O7S3/c1-12(2)19(24-34(28,29)14-5-7-16-17(10-14)31-9-8-30-16)20(25)23-21-22-15-6-4-13(33(3,26)27)11-18(15)32-21/h4-7,10-12,19,24H,8-9H2,1-3H3,(H,22,23,25)