Results for:
PubChem ID: 2820262

Methyl 3-[[(E)-2-tert-butylsulfonyl-2-cyanoethenyl]amino]thiophene-2-carboxylate

Compound Details

Synonymous names
MLS000859272
CHEMBL1360314
YMXNGSCUHAJUSI-CMDGGOBGSA-N
HMS1527J05
HMS2793G22
CCG-51725
NCGC00176688-01
SMR000459451
SR-01000641009-1
BRD-K16435739-001-01-1
Methyl 3-([(E)-2-(tert-butylsulfonyl)-2-cyanoethenyl]amino)-2-thiophenecarboxylate #
methyl 3-{[2-(tert-butylsulfonyl)-2-cyanovinyl]amino}thiophene-2-carboxylate
Thiophene-2-carboxylic acid, 3-(2-tert-butylsulfonyl-2-cyanoethenylamino)-, methyl ester
Microorganism:

Yes

IUPAC namemethyl 3-[[(E)-2-tert-butylsulfonyl-2-cyanoethenyl]amino]thiophene-2-carboxylate
SMILESCC(C)(C)S(=O)(=O)C(=CNC1=C(SC=C1)C(=O)OC)C#N
InchiInChI=1S/C13H16N2O4S2/c1-13(2,3)21(17,18)9(7-14)8-15-10-5-6-20-11(10)12(16)19-4/h5-6,8,15H,1-4H3/b9-8+
FormulaC13H16N2O4S2
PubChem ID2820262
Molweight328.4
LogP2.6
Atoms21
Bonds6
H-bond Acceptor7
H-bond Donor1
Chemical Classificationamines aromatic compounds esters heterocyclic compounds nitriles nitrogen compounds sulfonyls sulfur compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Pectobacterium CarotovorumKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Pectobacterium Carotovoruminoculated potato samplesGC-MSno