2-(2,4-dimethylphenyl)imino-3-methyl-3H-1,2-thiazol-2-ium

Systemtic Name: 2-(2,4-dimethylphenyl)imino-3-methyl-3H-1,2-thiazol-2-ium Openeye Name: 2-(2,4-dimethylphenyl)imino-3-methyl-3H-isothiazol-2-ium CAS Name: 2-(2,4-dimethylphenyl)imino-3-methyl-3H-isothiazol-2-ium IUPAC Name: 2-(2,4-dimethylphenyl)imino-3-methyl-3H-1,2-thiazol-2-ium Traditional Name: 2-(2,4-dimethylphenyl)imino-3-methyl-4-isothiazolin-2-ium Formula: C12H15N2S+ MolecularWeight: 219.3259

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CS[N+]1=NC2=C(C=C(C=C2)C)C

Isomeric SMILES

CC1C=CS[N+]1=NC2=C(C=C(C=C2)C)C

InChI

InChI=1S/C12H15N2S/c1-9-4-5-12(10(2)8-9)13-14-11(3)6-7-15-14/h4-8,11H,1-3H3/q+1