[2-(dimethylamino)phenyl]methyl N,N'-dimethylcarbamimidothioate

Systemtic Name: [2-(dimethylamino)phenyl]methyl N,N'-dimethylcarbamimidothioate Openeye Name: 2-[[2-(dimethylamino)phenyl]methyl]-1,3-dimethyl-isothiourea CAS Name: N,N'-dimethylcarbamimidothioic acid [2-(dimethylamino)phenyl]methyl ester IUPAC Name: [2-(dimethylamino)phenyl]methyl N,N'-dimethylcarbamimidothioate Traditional Name: 2-[2-(dimethylamino)benzyl]-1,3-dimethyl-isothiourea Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=NC)SCC1=CC=CC=C1N(C)C

Isomeric SMILES

CNC(=NC)SCC1=CC=CC=C1N(C)C

InChI

InChI=1S/C12H19N3S/c1-13-12(14-2)16-9-10-7-5-6-8-11(10)15(3)4/h5-8H,9H2,1-4H3,(H,13,14)