3-oxidanylidene-N'-(3,4,5-triethoxyphenyl)carbonyl-4H-1,4-benzothiazine-6-carbohydrazide

Systemtic Name: 3-oxidanylidene-N'-(3,4,5-triethoxyphenyl)carbonyl-4H-1,4-benzothiazine-6-carbohydrazide Openeye Name: 3-oxo-N'-(3,4,5-triethoxybenzoyl)-4H-1,4-benzothiazine-6-carbohydrazide CAS Name: 3-oxo-N'-[oxo-(3,4,5-triethoxyphenyl)methyl]-4H-1,4-benzothiazine-6-carbohydrazide IUPAC Name: 3-oxo-N'-(3,4,5-triethoxybenzoyl)-4H-1,4-benzothiazine-6-carbohydrazide Traditional Name: 3-keto-N'-(3,4,5-triethoxybenzoyl)-4H-1,4-benzothiazine-6-carbohydrazide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NNC(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C22H25N3O6S/c1-4-29-16-10-14(11-17(30-5-2)20(16)31-6-3)22(28)25-24-21(27)13-7-8-18-15(9-13)23-19(26)12-32-18/h7-11H,4-6,12H2,1-3H3,(H,23,26)(H,24,27)(H,25,28)