5-[(6-azanylidene-3-methyl-4-phenyl-pyridazin-1-yl)methyl]-1,2-thiazol-3-one

Systemtic Name: 5-[(6-azanylidene-3-methyl-4-phenyl-pyridazin-1-yl)methyl]-1,2-thiazol-3-one Openeye Name: 5-[(6-imino-3-methyl-4-phenyl-pyridazin-1-yl)methyl]isothiazol-3-one CAS Name: 5-[(6-imino-3-methyl-4-phenyl-1-pyridazinyl)methyl]-3-isothiazolone IUPAC Name: 5-[(6-imino-3-methyl-4-phenylpyridazin-1-yl)methyl]-1,2-thiazol-3-one Traditional Name: 5-[(6-imino-3-methyl-4-phenyl-pyridazin-1-yl)methyl]-4-isothiazolin-3-one Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N)C=C1C2=CC=CC=C2)CC3=CC(=O)NS3

Isomeric SMILES

CC1=NN(C(=N)C=C1C2=CC=CC=C2)CC3=CC(=O)NS3

InChI

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