4-(diethylamino)-N'-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]benzohydrazide

Systemtic Name: 4-(diethylamino)-N'-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoyl]benzohydrazide Openeye Name: 4-(diethylamino)-N'-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]benzohydrazide CAS Name: 4-(diethylamino)-N'-[2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-(diethylamino)-N'-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetyl]benzohydrazide Traditional Name: 4-(diethylamino)-N'-[2-[(1-oxidopyridin-1-ium-2-yl)thio]acetyl]benzohydrazide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C18H22N4O3S/c1-3-21(4-2)15-10-8-14(9-11-15)18(24)20-19-16(23)13-26-17-7-5-6-12-22(17)25/h5-12H,3-4,13H2,1-2H3,(H,19,23)(H,20,24)