N'-[(Z)-(4-methylsulfanylphenyl)methylideneamino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanediamide

Systemtic Name: N'-[(Z)-(4-methylsulfanylphenyl)methylideneamino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanediamide Openeye Name: N'-[(Z)-(4-methylsulfanylphenyl)methyleneamino]-N-(3-morpholin-4-ium-4-ylpropyl)oxamide CAS Name: N'-[(Z)-[4-(methylthio)phenyl]methylideneamino]-N-[3-(4-morpholin-4-iumyl)propyl]oxamide IUPAC Name: N'-[(Z)-(4-methylsulfanylphenyl)methylideneamino]-N-(3-morpholin-4-ium-4-ylpropyl)oxamide Traditional Name: N'-[(Z)-[4-(methylthio)benzylidene]amino]-N-(3-morpholin-4-ium-4-ylpropyl)oxamide Formula: C17H25N4O3S+ MolecularWeight: 365.4704

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=NNC(=O)C(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CSC1=CC=C(C=C1)/C=N\NC(=O)C(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C17H24N4O3S/c1-25-15-5-3-14(4-6-15)13-19-20-17(23)16(22)18-7-2-8-21-9-11-24-12-10-21/h3-6,13H,2,7-12H2,1H3,(H,18,22)(H,20,23)/p+1/b19-13-