[4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-phenyl] 4-ethoxybenzoate

Systemtic Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxy-phenyl] 4-ethoxybenzoate Openeye Name: [4-[(E)-(carbamothioylhydrazono)methyl]-2-ethoxy-phenyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-(carbamothioylhydrazinylidene)methyl]-2-ethoxyphenyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [2-ethoxy-4-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=S)N)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=S)N)OCC

InChI

InChI=1S/C19H21N3O4S/c1-3-24-15-8-6-14(7-9-15)18(23)26-16-10-5-13(11-17(16)25-4-2)12-21-22-19(20)27/h5-12H,3-4H2,1-2H3,(H3,20,22,27)/b21-12+