2-[2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanamide

Systemtic Name: 2-[2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanamide Openeye Name: 2-[2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazono)methyl]phenoxy]acetamide CAS Name: 2-[2-methoxy-4-[(Z)-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]acetamide IUPAC Name: 2-[2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenoxy]acetamide Traditional Name: 2-[2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylthiocarbamoylhydrazono)methyl]phenoxy]acetamide Formula: C17H26N5O4S+ MolecularWeight: 396.48444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCC[NH+]2CCOCC2)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\NC(=S)NCC[NH+]2CCOCC2)OCC(=O)N

InChI

InChI=1S/C17H25N5O4S/c1-24-15-10-13(2-3-14(15)26-12-16(18)23)11-20-21-17(27)19-4-5-22-6-8-25-9-7-22/h2-3,10-11H,4-9,12H2,1H3,(H2,18,23)(H2,19,21,27)/p+1/b20-11-