[4-(dimethylaminomethyl)pyridin-2-yl]methyl carbamimidothioate trihydrochloride

Systemtic Name: [4-(dimethylaminomethyl)pyridin-2-yl]methyl carbamimidothioate trihydrochloride Openeye Name: 2-[[4-(dimethylaminomethyl)-2-pyridyl]methyl]isothiourea trihydrochloride CAS Name: carbamimidothioic acid [4-(dimethylaminomethyl)-2-pyridinyl]methyl ester trihydrochloride IUPAC Name: [4-(dimethylaminomethyl)pyridin-2-yl]methyl carbamimidothioate trihydrochloride Traditional Name: 2-[[4-(dimethylaminomethyl)-2-pyridyl]methyl]isothiourea trihydrochloride Formula: C10H19Cl3N4S MolecularWeight: 333.70866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=NC=C1)CSC(=N)N.Cl.Cl.Cl

Isomeric SMILES

CN(C)CC1=CC(=NC=C1)CSC(=N)N.Cl.Cl.Cl

InChI

InChI=1S/C10H16N4S.3ClH/c1-14(2)6-8-3-4-13-9(5-8)7-15-10(11)12;;;/h3-5H,6-7H2,1-2H3,(H3,11,12);3*1H