methyl 4-[[2-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[2-[(E)-(cyclohexylcarbamothioylhydrazono)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-[(E)-[[(cyclohexylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(E)-(cyclohexylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-[(E)-(cyclohexylthiocarbamoylhydrazono)methyl]phenoxy]methyl]benzoic acid methyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=NNC(=S)NC3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2/C=N/NC(=S)NC3CCCCC3

InChI

InChI=1S/C23H27N3O3S/c1-28-22(27)18-13-11-17(12-14-18)16-29-21-10-6-5-7-19(21)15-24-26-23(30)25-20-8-3-2-4-9-20/h5-7,10-15,20H,2-4,8-9,16H2,1H3,(H2,25,26,30)/b24-15+