ethyl 7-[2-(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylhydrazinyl]-2-ethanoylimino-5,6-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 7-[2-(4-chloranyl-2-methyl-pyrazol-3-yl)carbonylhydrazinyl]-2-ethanoylimino-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-acetylimino-7-[2-(4-chloro-2-methyl-pyrazole-3-carbonyl)hydrazino]-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 2-acetylimino-7-[[(4-chloro-2-methyl-3-pyrazolyl)-oxomethyl]hydrazo]-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-acetylimino-7-[2-(4-chloro-2-methylpyrazole-3-carbonyl)hydrazinyl]-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 2-acetylimino-7-[N'-(4-chloro-2-methyl-pyrazole-3-carbonyl)hydrazino]-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C18H20ClN5O4S MolecularWeight: 437.9005

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCC(=C2SC1=NC(=O)C)NNC(=O)C3=C(C=NN3C)Cl

Isomeric SMILES

CCOC(=O)C1=C2CCCC(=C2SC1=NC(=O)C)NNC(=O)C3=C(C=NN3C)Cl

InChI

InChI=1S/C18H20ClN5O4S/c1-4-28-18(27)13-10-6-5-7-12(15(10)29-17(13)21-9(2)25)22-23-16(26)14-11(19)8-20-24(14)3/h8,22H,4-7H2,1-3H3,(H,23,26)