5-[(6-azanylidene-3-methyl-5-phenyl-pyridazin-1-yl)methyl]-1,2-thiazol-3-one hydrobromide

Systemtic Name: 5-[(6-azanylidene-3-methyl-5-phenyl-pyridazin-1-yl)methyl]-1,2-thiazol-3-one hydrobromide Openeye Name: 5-[(6-imino-3-methyl-5-phenyl-pyridazin-1-yl)methyl]isothiazol-3-one hydrobromide CAS Name: 5-[(6-imino-3-methyl-5-phenyl-1-pyridazinyl)methyl]-3-isothiazolone hydrobromide IUPAC Name: 5-[(6-imino-3-methyl-5-phenylpyridazin-1-yl)methyl]-1,2-thiazol-3-one hydrobromide Traditional Name: 5-[(6-imino-3-methyl-5-phenyl-pyridazin-1-yl)methyl]-4-isothiazolin-3-one hydrobromide Formula: C15H15BrN4OS MolecularWeight: 379.2748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N)C(=C1)C2=CC=CC=C2)CC3=CC(=O)NS3.Br

Isomeric SMILES

CC1=NN(C(=N)C(=C1)C2=CC=CC=C2)CC3=CC(=O)NS3.Br

InChI

InChI=1S/C15H14N4OS.BrH/c1-10-7-13(11-5-3-2-4-6-11)15(16)19(17-10)9-12-8-14(20)18-21-12;/h2-8,16H,9H2,1H3,(H,18,20);1H