[2-methoxy-4-[(E)-(oxolan-2-ylmethylcarbamothioylhydrazinylidene)methyl]phenyl] furan-2-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-(oxolan-2-ylmethylcarbamothioylhydrazinylidene)methyl]phenyl] furan-2-carboxylate Openeye Name: [2-methoxy-4-[(E)-(tetrahydrofuran-2-ylmethylcarbamothioylhydrazono)methyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [2-methoxy-4-[(E)-[[(2-oxolanylmethylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(oxolan-2-ylmethylcarbamothioylhydrazinylidene)methyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [2-methoxy-4-[(E)-(tetrahydrofurfurylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCC2CCCO2)OC(=O)C3=CC=CO3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)NCC2CCCO2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C19H21N3O5S/c1-24-17-10-13(6-7-15(17)27-18(23)16-5-3-9-26-16)11-21-22-19(28)20-12-14-4-2-8-25-14/h3,5-7,9-11,14H,2,4,8,12H2,1H3,(H2,20,22,28)/b21-11+