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CHEBI:121976 - N-cyano-N'-(2-fluorophenyl)carbamimidothioic acid [2-(tert-butylamino)-2-oxoethyl] ester

Default Structure
ChEBI IDCHEBI:121976
ChEBI NameN-cyano-N'-(2-fluorophenyl)carbamimidothioic acid [2-(tert-butylamino)-2-oxoethyl] ester
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DownloadsMolfile
FormulaC14H17FN4OS
Net Charge0
Average Mass308.382
Monoisotopic Mass308.11071
SMILESCC(C)(C)NC(=O)CSC(=Nc1ccccc1F)NC#N
InChIInChI=1S/C14H17FN4OS/c1-14(2,3)19-12(20)8-21-13(17-9-16)18-11-7-5-4-6-10(11)15/h4-7H,8H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyVFFBPTSOJOREGU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-cyano-N'-(2-fluorophenyl)carbamimidothioic acid [2-(tert-butylamino)-2-oxoethyl] ester (CHEBI:121976) is a organofluorine compound (CHEBI:37143)
Manual XrefsDatabases
LSM-33419LINCS