Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-[(2-chlorobenzyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL143409
SMILES Clc1ccccc1CSc1nc2ccsc2c(=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 C21H15ClN2O3S2 MW 442.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClN2O3S2/c22-15-4-2-1-3-14(15)11-29-21-23-16-7-8-28-19(16)20(25)24(21)10-13-5-6-17-18(9-13)27-12-26-17/h1-9H,10-12H2InChIKey
AJOKRSPFKJRBLV-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)2((2chlorobenzyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(13BENZODIOXOL5YLMETHYL)2((2CHLOROPHENYL)METHYLSULFANYL)THIENO(32D)PYRIMIDIN4ONE
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)N=C3SCC5=CC=CC=C5Cl
InChI=1SC21H15ClN2O3S2c2215421314(15)1129212316782819(16)20(25)24(21)1013561718(913)27122617h19H1012H2
MFCD03018714
ZINC000002909047
ZINC2909047
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