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

Systemtic Name: methyl 4-[[2-[(E)-(prop-2-enylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[2-[(E)-(allylcarbamothioylhydrazono)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-[(E)-[[(prop-2-enylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(E)-(prop-2-enylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-[(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=CC=C2C=NNC(=S)NCC=C

Isomeric SMILES

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

InChI

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