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

Systemtic Name: [4-[(E)-(butylcarbamothioylhydrazinylidene)methyl]-2-methoxy-phenyl] furan-2-carboxylate Openeye Name: [4-[(E)-(butylcarbamothioylhydrazono)methyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[(E)-[[butylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(butylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(E)-(butylthiocarbamoylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CC(=C(C=C1)OC(=O)C2=CC=CO2)OC

Isomeric SMILES

CCCCNC(=S)N/N=C/C1=CC(=C(C=C1)OC(=O)C2=CC=CO2)OC

InChI

InChI=1S/C18H21N3O4S/c1-3-4-9-19-18(26)21-20-12-13-7-8-14(16(11-13)23-2)25-17(22)15-6-5-10-24-15/h5-8,10-12H,3-4,9H2,1-2H3,(H2,19,21,26)/b20-12+