N-[2-(3,4-dimethoxyphenyl)-2-thiophen-2-ylsulfonyl-ethyl]-2-oxidanylidene-2-(2-pyridin-3-ylcarbonylhydrazinyl)ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-2-thiophen-2-ylsulfonyl-ethyl]-2-oxidanylidene-2-(2-pyridin-3-ylcarbonylhydrazinyl)ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-2-(2-thienylsulfonyl)ethyl]-2-oxo-2-[2-(pyridine-3-carbonyl)hydrazino]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-2-thiophen-2-ylsulfonylethyl]-2-oxo-2-[[oxo(3-pyridinyl)methyl]hydrazo]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-2-thiophen-2-ylsulfonylethyl]-2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]acetamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-2-(2-thienylsulfonyl)ethyl]-2-keto-2-(N'-nicotinoylhydrazino)acetamide Formula: C22H22N4O7S2 MolecularWeight: 518.56268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC(=O)C(=O)NNC(=O)C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC(=O)C(=O)NNC(=O)C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C22H22N4O7S2/c1-32-16-8-7-14(11-17(16)33-2)18(35(30,31)19-6-4-10-34-19)13-24-21(28)22(29)26-25-20(27)15-5-3-9-23-12-15/h3-12,18H,13H2,1-2H3,(H,24,28)(H,25,27)(H,26,29)