2-azanyl-N'-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-4-ethyl-1,3-thiazol-3-ium-5-carbohydrazide

Systemtic Name: 2-azanyl-N'-[(3-bromanyl-5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-4-ethyl-1,3-thiazol-3-ium-5-carbohydrazide Openeye Name: 2-amino-N'-[(3-bromo-5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-4-ethyl-thiazol-3-ium-5-carbohydrazide CAS Name: 2-amino-N'-[(3-bromo-5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-4-ethyl-5-thiazol-3-iumcarbohydrazide IUPAC Name: 2-amino-N'-[(3-bromo-5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-4-ethyl-1,3-thiazol-3-ium-5-carbohydrazide Traditional Name: 2-amino-N'-[(3-bromo-6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methyl]-4-ethyl-thiazol-3-ium-5-carbohydrazide Formula: C14H16BrN4O3S+ MolecularWeight: 400.27084

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=[NH+]1)N)C(=O)NNC=C2C=C(C=C(C2=O)OC)Br

Isomeric SMILES

CCC1=C(SC(=[NH+]1)N)C(=O)NNC=C2C=C(C=C(C2=O)OC)Br

InChI

InChI=1S/C14H15BrN4O3S/c1-3-9-12(23-14(16)18-9)13(21)19-17-6-7-4-8(15)5-10(22-2)11(7)20/h4-6,17H,3H2,1-2H3,(H2,16,18)(H,19,21)/p+1