(5-ethanoyl-2-methoxy-phenyl)methyl carbamimidothioate hydrochloride

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl carbamimidothioate hydrochloride Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methyl]isothiourea hydrochloride CAS Name: carbamimidothioic acid (5-acetyl-2-methoxyphenyl)methyl ester hydrochloride IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl carbamimidothioate hydrochloride Traditional Name: 2-(5-acetyl-2-methoxy-benzyl)isothiourea hydrochloride Formula: C11H15ClN2O2S MolecularWeight: 274.767

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC(=N)N.Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC(=N)N.Cl

InChI

InChI=1S/C11H14N2O2S.ClH/c1-7(14)8-3-4-10(15-2)9(5-8)6-16-11(12)13;/h3-5H,6H2,1-2H3,(H3,12,13);1H