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

Systemtic Name: [4-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]-2-ethoxy-phenyl] 4-chloranylbenzoate Openeye Name: [4-[(E)-(cyclohexylcarbamothioylhydrazono)methyl]-2-ethoxy-phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(E)-[[(cyclohexylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]-2-ethoxyphenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-[(E)-(cyclohexylthiocarbamoylhydrazono)methyl]-2-ethoxy-phenyl] ester Formula: C23H26ClN3O3S MolecularWeight: 459.98884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=S)NC2CCCCC2)OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=S)NC2CCCCC2)OC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H26ClN3O3S/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/h8-15,19H,2-7H2,1H3,(H2,26,27,31)/b25-15+