2-[(5-bromanylthiophen-3-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(5-bromanylthiophen-3-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(5-bromo-3-thienyl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(5-bromo-3-thiophenyl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(5-bromothiophen-3-yl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[(5-bromo-3-thienyl)methyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C12H10BrN3OS MolecularWeight: 324.1963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=CSC(=C2)Br)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=CSC(=C2)Br)C#N

InChI

InChI=1S/C12H10BrN3OS/c1-7-8(2)15-16(12(17)10(7)4-14)5-9-3-11(13)18-6-9/h3,6H,5H2,1-2H3