methyl N-[(2,6-dimethylpyridin-4-yl)methyl]-N,N'-dimethyl-carbamimidothioate

Systemtic Name: methyl N-[(2,6-dimethylpyridin-4-yl)methyl]-N,N'-dimethyl-carbamimidothioate Openeye Name: 1-[(2,6-dimethyl-4-pyridyl)methyl]-1,2,3-trimethyl-isothiourea CAS Name: N-[(2,6-dimethyl-4-pyridinyl)methyl]-N,N'-dimethylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[(2,6-dimethylpyridin-4-yl)methyl]-N,N'-dimethylcarbamimidothioate Traditional Name: 1-[(2,6-dimethyl-4-pyridyl)methyl]-1,2,3-trimethyl-isothiourea Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)CN(C)C(=NC)SC

Isomeric SMILES

CC1=CC(=CC(=N1)C)CN(C)C(=NC)SC

InChI

InChI=1S/C12H19N3S/c1-9-6-11(7-10(2)14-9)8-15(4)12(13-3)16-5/h6-7H,8H2,1-5H3