ethyl (6E)-7-chloranyl-2-ethanoylimino-6-[(2-pyridin-4-ylcarbonylhydrazinyl)methylidene]-4,5-dihydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl (6E)-7-chloranyl-2-ethanoylimino-6-[(2-pyridin-4-ylcarbonylhydrazinyl)methylidene]-4,5-dihydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl (6E)-2-acetylimino-7-chloro-6-[[2-(pyridine-4-carbonyl)hydrazino]methylene]-4,5-dihydrobenzothiophene-3-carboxylate CAS Name: (6E)-2-acetylimino-7-chloro-6-[[[oxo(pyridin-4-yl)methyl]hydrazo]methylidene]-4,5-dihydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6E)-2-acetylimino-7-chloro-6-[[2-(pyridine-4-carbonyl)hydrazinyl]methylidene]-4,5-dihydro-1-benzothiophene-3-carboxylate Traditional Name: (6E)-2-acetylimino-7-chloro-6-[(N'-isonicotinoylhydrazino)methylene]-4,5-dihydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCC(=CNNC(=O)C3=CC=NC=C3)C(=C2SC1=NC(=O)C)Cl

Isomeric SMILES

CCOC(=O)C1=C2CC/C(=C\NNC(=O)C3=CC=NC=C3)/C(=C2SC1=NC(=O)C)Cl

InChI

InChI=1S/C20H19ClN4O4S/c1-3-29-20(28)15-14-5-4-13(16(21)17(14)30-19(15)24-11(2)26)10-23-25-18(27)12-6-8-22-9-7-12/h6-10,23H,3-5H2,1-2H3,(H,25,27)/b13-10+,24-19?