Vitas-M small molecule compound
3-[(4-fluorobenzyl)sulfanyl]-5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STK550359
SMILES CSc1nc2sc3c(c2c2n1c(SCc1ccc(cc1)F)nn2)CC(OC3)C(C)C
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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 C21H21FN4OS3 MW 460.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN4OS3/c1-11(2)15-8-14-16(9-27-15)30-19-17(14)18-24-25-21(26(18)20(23-19)28-3)29-10-12-4-6-13(22)7-5-12/h4-7,11,15H,8-10H2,1-3H3InChIKey
HIGWTNVZSZMNCN-UHFFFAOYSA-NSynonyms
836629-53-93((4fluorobenzyl)sulfanyl)5(methylsulfanyl)10(propan2yl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
3((4fluorobenzyl)thio)10isopropyl5(methylthio)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
836629539
CC(C)C1CC2=C(CO1)SC3=C2C4=NN=C(N4C(=N3)SC)SCC5=CC=C(C=C5)F
InChI=1SC21H21FN4OS3c111(2)1581416(92715)301917(14)18242521(26(18)20(2319)283)2910124613(22)7512h471115H810H213H3
MFCD03688474
ZINC000002250826
ZINC000002250827
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