[2-methoxy-4-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]phenyl] benzoate

Systemtic Name: [2-methoxy-4-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]phenyl] benzoate Openeye Name: [2-methoxy-4-[(E)-(phenylcarbamothioylhydrazono)methyl]phenyl] benzoate CAS Name: benzoic acid [4-[(E)-[[anilino(sulfanylidene)methyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]phenyl] benzoate Traditional Name: benzoic acid [2-methoxy-4-[(E)-(phenylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)NC2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O3S/c1-27-20-14-16(15-23-25-22(29)24-18-10-6-3-7-11-18)12-13-19(20)28-21(26)17-8-4-2-5-9-17/h2-15H,1H3,(H2,24,25,29)/b23-15+