2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N'-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]ethanehydrazide

Systemtic Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N'-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]ethanehydrazide Openeye Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N'-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide CAS Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N'-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]acetohydrazide IUPAC Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N'-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Traditional Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N'-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide Formula: C19H21N4O3S+ MolecularWeight: 385.46004

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NNC=C3C=CC=C(C3=O)OC

Isomeric SMILES

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NNC=C3C=CC=C(C3=O)OC

InChI

InChI=1S/C19H20N4O3S/c1-3-23-15-9-5-4-8-14(15)21-19(23)27-12-17(24)22-20-11-13-7-6-10-16(26-2)18(13)25/h4-11H,3,12H2,1-2H3,(H2,20,22,24,25)/p+1