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

Systemtic Name: methyl N'-methyl-N-[2-[2-(5-methyl-1H-imidazol-4-yl)ethylsulfanyl]ethyl]carbamimidothioate Openeye Name: 2,3-dimethyl-1-[2-[2-(5-methyl-1H-imidazol-4-yl)ethylsulfanyl]ethyl]isothiourea CAS Name: N'-methyl-N-[2-[2-(5-methyl-1H-imidazol-4-yl)ethylthio]ethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-methyl-N-[2-[2-(5-methyl-1H-imidazol-4-yl)ethylsulfanyl]ethyl]carbamimidothioate Traditional Name: 2,3-dimethyl-1-[2-[2-(5-methyl-1H-imidazol-4-yl)ethylthio]ethyl]isothiourea Formula: C11H20N4S2 MolecularWeight: 272.4333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CCSCCNC(=NC)SC

Isomeric SMILES

CC1=C(N=CN1)CCSCCNC(=NC)SC

InChI

InChI=1S/C11H20N4S2/c1-9-10(15-8-14-9)4-6-17-7-5-13-11(12-2)16-3/h8H,4-7H2,1-3H3,(H,12,13)(H,14,15)