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

Systemtic Name: [2-methoxy-4-[(E)-(oxolan-2-ylmethylcarbamothioylhydrazinylidene)methyl]phenyl] thiophene-2-carboxylate Openeye Name: [2-methoxy-4-[(E)-(tetrahydrofuran-2-ylmethylcarbamothioylhydrazono)methyl]phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-methoxy-4-[(E)-[[(2-oxolanylmethylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(oxolan-2-ylmethylcarbamothioylhydrazinylidene)methyl]phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-methoxy-4-[(E)-(tetrahydrofurfurylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCC2CCCO2)OC(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)NCC2CCCO2)OC(=O)C3=CC=CS3

InChI

InChI=1S/C19H21N3O4S2/c1-24-16-10-13(6-7-15(16)26-18(23)17-5-3-9-28-17)11-21-22-19(27)20-12-14-4-2-8-25-14/h3,5-7,9-11,14H,2,4,8,12H2,1H3,(H2,20,22,27)/b21-11+