ethyl N'-[3-(aminomethyl)-2,4-dimethoxy-phenyl]carbamimidothioate

Systemtic Name: ethyl N'-[3-(aminomethyl)-2,4-dimethoxy-phenyl]carbamimidothioate Openeye Name: 3-[3-(aminomethyl)-2,4-dimethoxy-phenyl]-2-ethyl-isothiourea CAS Name: N'-[3-(aminomethyl)-2,4-dimethoxyphenyl]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[3-(aminomethyl)-2,4-dimethoxyphenyl]carbamimidothioate Traditional Name: 3-[3-(aminomethyl)-2,4-dimethoxy-phenyl]-2-ethyl-isothiourea Formula: C12H19N3O2S MolecularWeight: 269.36316

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=C(C(=C(C=C1)OC)CN)OC)N

Isomeric SMILES

CCSC(=NC1=C(C(=C(C=C1)OC)CN)OC)N

InChI

InChI=1S/C12H19N3O2S/c1-4-18-12(14)15-9-5-6-10(16-2)8(7-13)11(9)17-3/h5-6H,4,7,13H2,1-3H3,(H2,14,15)