(5E)-2-(2,5-dimethylphenyl)imino-5-[(1-methylpyrazol-4-yl)methylidene]-1,3-thiazol-4-olate

Systemtic Name: (5E)-2-(2,5-dimethylphenyl)imino-5-[(1-methylpyrazol-4-yl)methylidene]-1,3-thiazol-4-olate Openeye Name: (5E)-2-(2,5-dimethylphenyl)imino-5-[(1-methylpyrazol-4-yl)methylene]thiazol-4-olate CAS Name: (5E)-2-(2,5-dimethylphenyl)imino-5-[(1-methyl-4-pyrazolyl)methylidene]-4-thiazololate IUPAC Name: (5E)-2-(2,5-dimethylphenyl)imino-5-[(1-methylpyrazol-4-yl)methylidene]-1,3-thiazol-4-olate Traditional Name: (5E)-2-(2,5-dimethylphenyl)imino-5-[(1-methylpyrazol-4-yl)methylene]-3-thiazolin-4-olate Formula: C16H15N4OS- MolecularWeight: 311.3815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N=C2N=C(C(=CC3=CN(N=C3)C)S2)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N=C2N=C(/C(=C\C3=CN(N=C3)C)/S2)[O-]

InChI

InChI=1S/C16H16N4OS/c1-10-4-5-11(2)13(6-10)18-16-19-15(21)14(22-16)7-12-8-17-20(3)9-12/h4-9H,1-3H3,(H,18,19,21)/p-1/b14-7+