1-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-5-nitro-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[2-(5-bromo-2-thienyl)-2-oxo-ethyl]-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[2-(5-bromo-2-thiophenyl)-2-oxoethyl]-5-nitro-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 1-[2-(5-bromo-2-thienyl)-2-keto-ethyl]-2-keto-5-nitro-nicotinonitrile Formula: C12H6BrN3O4S MolecularWeight: 368.16274

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)Br)C(=O)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=C1)Br)C(=O)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H6BrN3O4S/c13-11-2-1-10(21-11)9(17)6-15-5-8(16(19)20)3-7(4-14)12(15)18/h1-3,5H,6H2