Vitas-M small molecule compound
3-[(4-chlorobenzyl)sulfanyl]-10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STK929654
SMILES CCC1(C)OCc2c(C1)c1c(s2)nc(n2c1nnc2SCc1ccc(cc1)Cl)SC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H21ClN4OS3 MW 477.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4OS3/c1-4-21(2)9-14-15(10-27-21)30-18-16(14)17-24-25-20(26(17)19(23-18)28-3)29-11-12-5-7-13(22)8-6-12/h5-8H,4,9-11H2,1-3H3InChIKey
IVTJDFYAEOOPBJ-UHFFFAOYSA-NSynonyms
799785-39-03((4chlorobenzyl)sulfanyl)10ethyl10methyl5(methylsulfanyl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
3((4chlorobenzyl)thio)10ethyl10methyl5(methylthio)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
799785390
CCC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C(=N3)SC)SCC5=CC=C(C=C5)Cl)C
InChI=1SC21H21ClN4OS3c1421(2)91415(102721)301816(14)17242520(26(17)19(2318)283)2911125713(22)8612h58H4911H213H3
MFCD03675285
ZINC000013660829
ZINC000013660832
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