[2,6-dimethoxy-4-[(Z)-(3-morpholin-4-ium-4-ylpropylcarbamothioylhydrazinylidene)methyl]phenyl] ethanoate

Systemtic Name: [2,6-dimethoxy-4-[(Z)-(3-morpholin-4-ium-4-ylpropylcarbamothioylhydrazinylidene)methyl]phenyl] ethanoate Openeye Name: [2,6-dimethoxy-4-[(Z)-(3-morpholin-4-ium-4-ylpropylcarbamothioylhydrazono)methyl]phenyl] acetate CAS Name: acetic acid [2,6-dimethoxy-4-[(Z)-[[[3-(4-morpholin-4-iumyl)propylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2,6-dimethoxy-4-[(Z)-(3-morpholin-4-ium-4-ylpropylcarbamothioylhydrazinylidene)methyl]phenyl] acetate Traditional Name: acetic acid [2,6-dimethoxy-4-[(Z)-(3-morpholin-4-ium-4-ylpropylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C19H29N4O5S+ MolecularWeight: 425.52236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C=NNC(=S)NCCC[NH+]2CCOCC2)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)/C=N\NC(=S)NCCC[NH+]2CCOCC2)OC

InChI

InChI=1S/C19H28N4O5S/c1-14(24)28-18-16(25-2)11-15(12-17(18)26-3)13-21-22-19(29)20-5-4-6-23-7-9-27-10-8-23/h11-13H,4-10H2,1-3H3,(H2,20,22,29)/p+1/b21-13-