3-[(E)-2-(5-bromanylthiophen-2-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile

Systemtic Name: 3-[(E)-2-(5-bromanylthiophen-2-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-(5-bromo-2-thienyl)vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 3-[(E)-2-(5-bromo-2-thiophenyl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 3-[(E)-2-(5-bromothiophen-2-yl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 3-[(E)-2-(5-bromo-2-thienyl)vinyl]-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C12H8BrN3OS MolecularWeight: 322.18042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C=CC2=CC=C(S2)Br)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1/C=C/C2=CC=C(S2)Br)C#N

InChI

InChI=1S/C12H8BrN3OS/c1-7-9(6-14)12(17)16-15-10(7)4-2-8-3-5-11(13)18-8/h2-5H,1H3,(H,16,17)/b4-2+