Vitas-M small molecule compound

3-(1,3-benzodioxol-5-ylmethyl)-2-[(2-chloro-4-fluorobenzyl)sulfanyl]thieno[3,2-d]pyrimidin-4(3H)-one

Catalog ID
STL143415
SMILES Fc1ccc(c(c1)Cl)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 C21H14ClFN2O3S2 MW 460.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClFN2O3S2/c22-15-8-14(23)3-2-13(15)10-30-21-24-16-5-6-29-19(16)20(26)25(21)9-12-1-4-17-18(7-12)28-11-27-17/h1-8H,9-11H2
InChIKey
ZHHAWNCIKZABQJ-UHFFFAOYSA-N
Synonyms

3(13benzodioxol5ylmethyl)2((2chloro4fluorobenzyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(13BENZODIOXOL5YLMETHYL)2((2CHLORO4FLUOROPHENYL)METHYLSULFANYL)THIENO(32D)PYRIMIDIN4ONE
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)N=C3SCC5=C(C=C(C=C5)F)Cl
InChI=1SC21H14ClFN2O3S2c2215814(23)3213(15)1030212416562919(16)20(26)25(21)912141718(712)28112717h18H911H2
MFCD03018780
ZINC000002909157
ZINC2909157

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Available files

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