N-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)piazthiole-5-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=NSN=C4C=C3)OCC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=NSN=C4C=C3)OCC(C1=O)(C)C

InChI

InChI=1S/C20H20N4O3S/c1-4-24-16-8-6-13(10-17(16)27-11-20(2,3)19(24)26)21-18(25)12-5-7-14-15(9-12)23-28-22-14/h5-10H,4,11H2,1-3H3,(H,21,25)