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

Systemtic Name: 2-[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[2-(5-bromo-2-thienyl)-2-oxo-ethyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[2-(5-bromo-2-thiophenyl)-2-oxoethyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[2-(5-bromothiophen-2-yl)-2-oxoethyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[2-(5-bromo-2-thienyl)-2-keto-ethyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C13H10BrN3O2S MolecularWeight: 352.2064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)C2=CC=C(S2)Br)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)C2=CC=C(S2)Br)C#N

InChI

InChI=1S/C13H10BrN3O2S/c1-7-8(2)16-17(13(19)9(7)5-15)6-10(18)11-3-4-12(14)20-11/h3-4H,6H2,1-2H3