methyl N'-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]carbamimidothioate

Systemtic Name: methyl N'-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]carbamimidothioate Openeye Name: 3-[2-[(3-chloro-2-pyridyl)methylsulfanyl]ethyl]-2-methyl-isothiourea CAS Name: N'-[2-[(3-chloro-2-pyridinyl)methylthio]ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-[(3-chloropyridin-2-yl)methylsulfanyl]ethyl]carbamimidothioate Traditional Name: 3-[2-[(3-chloro-2-pyridyl)methylthio]ethyl]-2-methyl-isothiourea Formula: C10H14ClN3S2 MolecularWeight: 275.82126

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCSCC1=C(C=CC=N1)Cl)N

Isomeric SMILES

CSC(=NCCSCC1=C(C=CC=N1)Cl)N

InChI

InChI=1S/C10H14ClN3S2/c1-15-10(12)14-5-6-16-7-9-8(11)3-2-4-13-9/h2-4H,5-7H2,1H3,(H2,12,14)