N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethanamide

Systemtic Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethanamide Openeye Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-(4-methyl-2-oxo-thiazol-3-yl)acetamide CAS Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-(4-methyl-2-oxo-3-thiazolyl)acetamide IUPAC Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-2-(2-keto-4-methyl-4-thiazolin-3-yl)acetamide Formula: C21H21N3O6S2 MolecularWeight: 475.53794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CC(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CSC(=O)N1CC(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H21N3O6S2/c1-14-13-31-21(26)24(14)12-20(25)22-15-3-5-16(6-4-15)23-32(27,28)17-7-8-18-19(11-17)30-10-2-9-29-18/h3-8,11,13,23H,2,9-10,12H2,1H3,(H,22,25)