[4-[[(3,4-dimethoxyphenyl)carbamothioylhydrazinylidene]methyl]-2-methoxy-phenyl] furan-2-carboxylate

Systemtic Name: [4-[[(3,4-dimethoxyphenyl)carbamothioylhydrazinylidene]methyl]-2-methoxy-phenyl] furan-2-carboxylate Openeye Name: [4-[[(3,4-dimethoxyphenyl)carbamothioylhydrazono]methyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[(3,4-dimethoxyphenyl)carbamothioylhydrazinylidene]methyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[[(3,4-dimethoxyphenyl)thiocarbamoylhydrazono]methyl]-2-methoxy-phenyl] ester Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CO3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CO3)OC)OC

InChI

InChI=1S/C22H21N3O6S/c1-27-16-9-7-15(12-20(16)29-3)24-22(32)25-23-13-14-6-8-17(19(11-14)28-2)31-21(26)18-5-4-10-30-18/h4-13H,1-3H3,(H2,24,25,32)