Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-[(3-fluorobenzyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL166922
SMILES Fc1cccc(c1)CSc1nc2ccsc2c(=O)n1Cc1ccc2c(c1)OCO2
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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 C21H15FN2O3S2 MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN2O3S2/c22-15-3-1-2-14(8-15)11-29-21-23-16-6-7-28-19(16)20(25)24(21)10-13-4-5-17-18(9-13)27-12-26-17/h1-9H,10-12H2InChIKey
NVWAOBLWGUWZFS-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)2((3fluorobenzyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(13BENZODIOXOL5YLMETHYL)2((3FLUOROPHENYL)METHYLSULFANYL)THIENO(32D)PYRIMIDIN4ONE
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)N=C3SCC5=CC(=CC=C5)F
InChI=1SC21H15FN2O3S2c221531214(815)1129212316672819(16)20(25)24(21)1013451718(913)27122617h19H1012H2
MFCD03018721
ZINC000002909057
ZINC2909057
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