3-[4-methyl-1-(4-methylsulfanylphenyl)imidazol-2-yl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 3-[4-methyl-1-(4-methylsulfanylphenyl)imidazol-2-yl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 3-[4-methyl-1-(4-methylsulfanylphenyl)imidazol-2-yl]-1-oxido-pyridin-1-ium CAS Name: 3-[4-methyl-1-[4-(methylthio)phenyl]-2-imidazolyl]-1-oxidopyridin-1-ium IUPAC Name: 3-[4-methyl-1-(4-methylsulfanylphenyl)imidazol-2-yl]-1-oxidopyridin-1-ium Traditional Name: 3-[4-methyl-1-[4-(methylthio)phenyl]imidazol-2-yl]-1-oxido-pyridin-1-ium Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=N1)C2=C[N+](=CC=C2)[O-])C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CN(C(=N1)C2=C[N+](=CC=C2)[O-])C3=CC=C(C=C3)SC

InChI

InChI=1S/C16H15N3OS/c1-12-10-19(14-5-7-15(21-2)8-6-14)16(17-12)13-4-3-9-18(20)11-13/h3-11H,1-2H3