[2-ethoxy-4-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [2-ethoxy-4-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]phenyl] 4-chloranylbenzoate Openeye Name: [2-ethoxy-4-[(E)-(phenylcarbamothioylhydrazono)methyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(E)-[[anilino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [2-ethoxy-4-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-ethoxy-4-[(E)-(phenylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C23H20ClN3O3S MolecularWeight: 453.9412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=S)NC2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=S)NC2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H20ClN3O3S/c1-2-29-21-14-16(15-25-27-23(31)26-19-6-4-3-5-7-19)8-13-20(21)30-22(28)17-9-11-18(24)12-10-17/h3-15H,2H2,1H3,(H2,26,27,31)/b25-15+