(2-{[(5-Methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)carbamodithioic acid

Base Information

• Chemical Name: (2-{[(5-Methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)carbamodithioic acid
• CAS No.: 55317-80-1
• Molecular Formula: C8H13N3S3
• DSSTox Substance ID: DTXSID20574379
• Wikidata: Q82463396

Synonyms:55317-80-1;(2-(((5-Methyl-1H-imidazol-4-yl)methyl)thio)ethyl)carbamodithioic acid;SCHEMBL10854524;DTXSID20574379;DJFNUVQFNPDLFL-UHFFFAOYSA-N;N-[2-((5-methyl-4-imidazolyl)methylthio)ethyl]dithiocarbamic acid;(2-{[(5-Methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)carbamodithioic acid;N-[2-((4-methyl-5-imidazolyl) methylthio)ethyl]dithiocarbamic acid;N-[2-((4-methyl-5-imidazolyl)methylthio)ethyl] dithiocarbamic acid;N-[2-((4-methyl-5-imidazolyl)methylthio)ethyl]dithiocarbamic acid;N-[2-((5-methyl-4-imidazolyl)-methylthio)ethyl]dithiocarbamic acid;N-[2-((5-methyl-4imidazolyl)methylthio)ethyl]dithiocarbamic acid

Chemical Property of (2-{[(5-Methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)carbamodithioic acid

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 247.02716095
• Heavy Atom Count: 14
• Complexity: 189

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N=CN1)CSCCNC(=S)S

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