Vitas-M small molecule compound
pentyl {[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetate
Catalog ID
STL227041
SMILES CCCCCOC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(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 C25H33N3O3S2 MW 487.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O3S2/c1-6-7-8-9-30-19(29)13-32-24-22-21(26-14-27-24)20-16-11-25(4,5)31-12-17(16)18(10-15(2)3)28-23(20)33-22/h14-15H,6-13H2,1-5H3InChIKey
PMENAFPBTDRPOM-UHFFFAOYSA-NSynonyms
799801-82-4799801824
CCCCCOC(=O)CSC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)CC(C)C
InChI=1SC25H33N3O3S2c167893019(29)1332242221(26142724)20161125(45)311217(16)18(1015(2)3)2823(20)3322h1415H613H215H3
MFCD03678684
pentyl((22dimethyl5(2methylpropyl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)acetate
pentyl2((5isobutyl22dimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)acetate
ZINC000002224260
ZINC02224260
ZINC2224260
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