ethyl 5-[(E)-[(4-chlorophenyl)carbamothioylhydrazinylidene]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: ethyl 5-[(E)-[(4-chlorophenyl)carbamothioylhydrazinylidene]methyl]-2-methyl-furan-3-carboxylate Openeye Name: ethyl 5-[(E)-[(4-chlorophenyl)carbamothioylhydrazono]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[(E)-[[(4-chloroanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(E)-[(4-chlorophenyl)carbamothioylhydrazinylidene]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[(E)-[(4-chlorophenyl)thiocarbamoylhydrazono]methyl]-2-methyl-furan-3-carboxylic acid ethyl ester Formula: C16H16ClN3O3S MolecularWeight: 365.83454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1)C=NNC(=S)NC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1)/C=N/NC(=S)NC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H16ClN3O3S/c1-3-22-15(21)14-8-13(23-10(14)2)9-18-20-16(24)19-12-6-4-11(17)5-7-12/h4-9H,3H2,1-2H3,(H2,19,20,24)/b18-9+