methyl N-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-N'-methyl-carbamimidothioate

Systemtic Name: methyl N-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-N'-methyl-carbamimidothioate Openeye Name: 1-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-2,3-dimethyl-isothiourea CAS Name: N-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylthio]ethyl]-N'-methylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-N'-methylcarbamimidothioate Traditional Name: 1-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylthio]ethyl]-2,3-dimethyl-isothiourea Formula: C8H15N5S3 MolecularWeight: 277.4332

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCSCC1=NN=C(S1)N)SC

Isomeric SMILES

CN=C(NCCSCC1=NN=C(S1)N)SC

InChI

InChI=1S/C8H15N5S3/c1-10-8(14-2)11-3-4-15-5-6-12-13-7(9)16-6/h3-5H2,1-2H3,(H2,9,13)(H,10,11)