(5-ethanoyl-2-methoxy-phenyl)methyl N,N'-dimethylcarbamimidothioate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl N,N'-dimethylcarbamimidothioate Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methyl]-1,3-dimethyl-isothiourea CAS Name: N,N'-dimethylcarbamimidothioic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl N,N'-dimethylcarbamimidothioate Traditional Name: 2-(5-acetyl-2-methoxy-benzyl)-1,3-dimethyl-isothiourea Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC(=NC)NC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC(=NC)NC

InChI

InChI=1S/C13H18N2O2S/c1-9(16)10-5-6-12(17-4)11(7-10)8-18-13(14-2)15-3/h5-7H,8H2,1-4H3,(H,14,15)