(3,5-dimethyl-1,2-oxazol-4-yl)methyl N,N'-dimethylcarbamimidothioate hydrochloride

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl N,N'-dimethylcarbamimidothioate hydrochloride Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methyl]-1,3-dimethyl-isothiourea hydrochloride CAS Name: N,N'-dimethylcarbamimidothioic acid (3,5-dimethyl-4-isoxazolyl)methyl ester hydrochloride IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl N,N'-dimethylcarbamimidothioate hydrochloride Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methyl]-1,3-dimethyl-isothiourea hydrochloride Formula: C9H16ClN3OS MolecularWeight: 249.76084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC(=NC)NC.Cl

Isomeric SMILES

CC1=C(C(=NO1)C)CSC(=NC)NC.Cl

InChI

InChI=1S/C9H15N3OS.ClH/c1-6-8(7(2)13-12-6)5-14-9(10-3)11-4;/h5H2,1-4H3,(H,10,11);1H