methyl 4-[[4-[(E)-(prop-2-enylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(E)-(prop-2-enylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(E)-(allylcarbamothioylhydrazono)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-[[(prop-2-enylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-(prop-2-enylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-(allylthiocarbamoylhydrazono)methyl]phenoxy]methyl]benzoic acid methyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=NNC(=S)NCC=C

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-3-12-21-20(27)23-22-13-15-6-10-18(11-7-15)26-14-16-4-8-17(9-5-16)19(24)25-2/h3-11,13H,1,12,14H2,2H3,(H2,21,23,27)/b22-13+