Results for:
PubChem ID: 273249

S-(3,5-dioxo-2H-1,2,4-triazin-6-yl) Benzenecarbothioate

Compound Details

Synonymous names
MLS002706792
S-(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl) benzenecarbothioate
NSC118349
CHEMBL1719648
DTXSID40946993
NADNGNYULOPOGE-UHFFFAOYSA-N
STK970951
AKOS002346542
MCULE-4760471751
NSC-118349
SMR001574191
AB00682022-01
1,2,4-Triazine-3,5(2H,4H)-dione, 6-benzoylthio-
S-(3,5-Dihydroxy-1,2,4-triazin-6-yl) benzenecarbothioate
S-(3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl) benzenecarbothioate #
Microorganism:

Yes

IUPAC nameS-(3,5-dioxo-2H-1,2,4-triazin-6-yl) benzenecarbothioate
SMILESC1=CC=C(C=C1)C(=O)SC2=NNC(=O)NC2=O
InchiInChI=1S/C10H7N3O3S/c14-7-8(12-13-10(16)11-7)17-9(15)6-4-2-1-3-5-6/h1-5H,(H2,11,13,14,16)
FormulaC10H7N3O3S
PubChem ID273249
Molweight249.25
LogP1.5
Atoms17
Bonds3
H-bond Acceptor5
H-bond Donor2
Chemical Classificationsulfur compounds carbamides nitrogen compounds sulfides amides azines thioethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno