(5-bromanylthiophen-2-yl)methyl-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-methyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]-methyl-ammonium Formula: C14H16BrN4OS+ MolecularWeight: 368.27204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)C[NH+](C)CC2=CC=C(S2)Br)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)C[NH+](C)CC2=CC=C(S2)Br)C#N

InChI

InChI=1S/C14H15BrN4OS/c1-9-10(2)17-19(14(20)12(9)6-16)8-18(3)7-11-4-5-13(15)21-11/h4-5H,7-8H2,1-3H3/p+1