ethyl 4-[5-[(E)-(furan-2-ylmethylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(E)-(furan-2-ylmethylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-(2-furylmethylcarbamothioylhydrazono)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-[[(2-furanylmethylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-(furan-2-ylmethylcarbamothioylhydrazinylidene)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-(2-furfurylthiocarbamoylhydrazono)methyl]-2-furyl]benzoic acid ethyl ester Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=S)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=N/NC(=S)NCC3=CC=CO3

InChI

InChI=1S/C20H19N3O4S/c1-2-25-19(24)15-7-5-14(6-8-15)18-10-9-17(27-18)13-22-23-20(28)21-12-16-4-3-11-26-16/h3-11,13H,2,12H2,1H3,(H2,21,23,28)/b22-13+