magnesium 2,6-dimethyl-1-oxidanidyl-pyridin-1-ium diisothiocyanate

Systemtic Name: magnesium 2,6-dimethyl-1-oxidanidyl-pyridin-1-ium diisothiocyanate Openeye Name: magnesium 2,6-dimethyl-1-oxido-pyridin-1-ium diisothiocyanate CAS Name: magnesium 2,6-dimethyl-1-oxidopyridin-1-ium diisothiocyanate IUPAC Name: magnesium 2,6-dimethyl-1-oxidopyridin-1-ium diisothiocyanate Traditional Name: magnesium 2,6-dimethyl-1-oxido-pyridin-1-ium diisothiocyanate Formula: C16H18MgN4O2S2 MolecularWeight: 386.77472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC=C1)C)[O-].CC1=[N+](C(=CC=C1)C)[O-].C(=[N-])=S.C(=[N-])=S.[Mg+2]

Isomeric SMILES

CC1=[N+](C(=CC=C1)C)[O-].CC1=[N+](C(=CC=C1)C)[O-].C(=[N-])=S.C(=[N-])=S.[Mg+2]

InChI

InChI=1S/2C7H9NO.2CNS.Mg/c2*1-6-4-3-5-7(2)8(6)9;2*2-1-3;/h2*3-5H,1-2H3;;;/q;;2*-1;+2