2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethyl N-cyano-N'-methyl-carbamimidothioate

Systemtic Name: 2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethyl N-cyano-N'-methyl-carbamimidothioate Openeye Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethyl]-1-cyano-3-methyl-isothiourea CAS Name: N-cyano-N'-methylcarbamimidothioic acid 2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethyl ester IUPAC Name: 2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethyl N-cyano-N'-methylcarbamimidothioate Traditional Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethyl]-1-cyano-3-methyl-isothiourea Formula: C9H12BrN5S2 MolecularWeight: 334.25908

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NC#N)SCCSCC1=C(N=CN1)Br

Isomeric SMILES

CN=C(NC#N)SCCSCC1=C(N=CN1)Br

InChI

InChI=1S/C9H12BrN5S2/c1-12-9(13-5-11)17-3-2-16-4-7-8(10)15-6-14-7/h6H,2-4H2,1H3,(H,12,13)(H,14,15)