Products 335401-44-0

CAS 335401-44-0 appears in our catalog under these names: BDW568, BDW568, 99.4%. Offered by: TargetMol, GLPBio, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, 5 mg, 1 mg.

BDW568
TargetMol, GLPBio
  • size: 1mg, 5mg, 10mg
  • Variants: 6
from 802.98
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BDW568, 99.4%
MedChemExpress
  • size: 5 mg, 1 mg
  • Variants: 2
from 909.48
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Structural formula: {0} (CAS {1})

Methyl 2-[(11,12-dimethyl-10-thia-3,4,6,8-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-5-yl)sulfanyl]acetate (CAS 335401-44-0) is a chemical compound with the molecular formula C12H12N4O2S2 and a molecular weight of 308.4 g/mol. IUPAC name: methyl 2-[(11,12-dimethyl-10-thia-3,4,6,8-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-5-yl)sulfanyl]acetate. InChIKey: RNNRGNUAQCUYEG-UHFFFAOYSA-N.

Identity
Molecular formulaC12H12N4O2S2
Molecular weight308.4 g/mol
IUPAC namemethyl 2-[(11,12-dimethyl-10-thia-3,4,6,8-tetrazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-5-yl)sulfanyl]acetate
InChIKeyRNNRGNUAQCUYEG-UHFFFAOYSA-N
SMILESCC1=C(SC2=C1C3=NN=C(N3C=N2)SCC(=O)OC)C

Computed by PubChem (NCBI)

Synonyms: orb1979964
Isomers (same molecular formula)
3-[(2-nitrophenyl)sulfanylmethyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione C12H12N4O2S2
3-[4-(4-methylsulfanylthiophen-3-yl)triazol-1-yl]piperidine-2,6-dione C12H12N4O2S2