methyl 5-[[2-ethoxy-4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[2-ethoxy-4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[2-ethoxy-4-[(E)-(methylcarbamothioylhydrazono)methyl]phenoxy]methyl]furan-2-carboxylate CAS Name: 5-[[2-ethoxy-4-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-ethoxy-4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]furan-2-carboxylate Traditional Name: 5-[[2-ethoxy-4-[(E)-(methylthiocarbamoylhydrazono)methyl]phenoxy]methyl]furan-2-carboxylic acid methyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=S)NC)OCC2=CC=C(O2)C(=O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=S)NC)OCC2=CC=C(O2)C(=O)OC

InChI

InChI=1S/C18H21N3O5S/c1-4-24-16-9-12(10-20-21-18(27)19-2)5-7-14(16)25-11-13-6-8-15(26-13)17(22)23-3/h5-10H,4,11H2,1-3H3,(H2,19,21,27)/b20-10+