2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethyl-4,5-dihydro-1H-imidazol-3-ium-3-carbothioamide

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethyl-4,5-dihydro-1H-imidazol-3-ium-3-carbothioamide Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethyl-4,5-dihydro-1H-imidazol-3-ium-3-carbothioamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)amino]-N-ethyl-4,5-dihydro-1H-imidazol-3-ium-3-carbothioamide IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethyl-4,5-dihydro-1H-imidazol-3-ium-3-carbothioamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-ethyl-2-imidazolin-1-ium-1-carbothioamide Formula: C12H19N6S+ MolecularWeight: 279.38446

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)[N+]1=C(NCC1)NC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCNC(=S)[N+]1=C(NCC1)NC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C12H18N6S/c1-4-13-12(19)18-6-5-14-11(18)17-10-15-8(2)7-9(3)16-10/h7H,4-6H2,1-3H3,(H2,13,14,15,16,17,19)/p+1