2-[[(3E)-3-[2-(3-methylbutyl)-3,5-bis(oxidanylidene)-6-thiophen-2-yl-pyridazin-4-ylidene]-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-7-yl]oxy]ethanamide

Systemtic Name: 2-[[(3E)-3-[2-(3-methylbutyl)-3,5-bis(oxidanylidene)-6-thiophen-2-yl-pyridazin-4-ylidene]-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-7-yl]oxy]ethanamide Openeye Name: 2-[[(3E)-3-[2-isopentyl-3,5-dioxo-6-(2-thienyl)pyridazin-4-ylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]oxy]acetamide CAS Name: 2-[[(3E)-3-[2-(3-methylbutyl)-3,5-dioxo-6-thiophen-2-yl-4-pyridazinylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]oxy]acetamide IUPAC Name: 2-[[(3E)-3-[2-(3-methylbutyl)-3,5-dioxo-6-thiophen-2-ylpyridazin-4-ylidene]-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]oxy]acetamide Traditional Name: 2-[[(3E)-3-[2-isoamyl-3,5-diketo-6-(2-thienyl)pyridazin-4-ylidene]-1,1-diketo-4H-1$l^{6},2,4-benzothiadiazin-7-yl]oxy]acetamide Formula: C22H23N5O6S2 MolecularWeight: 517.57792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C(=C2NC3=C(C=C(C=C3)OCC(=O)N)S(=O)(=O)N2)C(=O)C(=N1)C4=CC=CS4

Isomeric SMILES

CC(C)CCN1C(=O)/C(=C/2\NC3=C(C=C(C=C3)OCC(=O)N)S(=O)(=O)N2)/C(=O)C(=N1)C4=CC=CS4

InChI

InChI=1S/C22H23N5O6S2/c1-12(2)7-8-27-22(30)18(20(29)19(25-27)15-4-3-9-34-15)21-24-14-6-5-13(33-11-17(23)28)10-16(14)35(31,32)26-21/h3-6,9-10,12,24,26H,7-8,11H2,1-2H3,(H2,23,28)/b21-18+