[2-methoxy-4-[(Z)-[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenyl] furan-2-carboxylate

Systemtic Name: [2-methoxy-4-[(Z)-[(phenylmethyl)carbamothioylhydrazinylidene]methyl]phenyl] furan-2-carboxylate Openeye Name: [4-[(Z)-(benzylcarbamothioylhydrazono)methyl]-2-methoxy-phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [2-methoxy-4-[(Z)-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(Z)-(benzylcarbamothioylhydrazinylidene)methyl]-2-methoxyphenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(Z)-(benzylthiocarbamoylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCC2=CC=CC=C2)OC(=O)C3=CC=CO3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\NC(=S)NCC2=CC=CC=C2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C21H19N3O4S/c1-26-19-12-16(9-10-17(19)28-20(25)18-8-5-11-27-18)14-23-24-21(29)22-13-15-6-3-2-4-7-15/h2-12,14H,13H2,1H3,(H2,22,24,29)/b23-14-