2-acetamido-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-acetamido-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-acetamido-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]thiazole-4-carboxamide CAS Name: 2-acetamido-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-4-thiazolecarboxamide IUPAC Name: 2-acetamido-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-acetamido-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]thiazole-4-carboxamide Formula: C21H20N4O6S2 MolecularWeight: 488.5367

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H20N4O6S2/c1-13(26)22-21-24-17(12-32-21)20(27)23-14-3-5-15(6-4-14)25-33(28,29)16-7-8-18-19(11-16)31-10-2-9-30-18/h3-8,11-12,25H,2,9-10H2,1H3,(H,23,27)(H,22,24,26)