Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-thioxo-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Catalog ID
STL145089
SMILES S=c1[nH]c2ccsc2c(=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 C14H10N2O3S2 MW 318.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10N2O3S2/c17-13-12-9(3-4-21-12)15-14(20)16(13)6-8-1-2-10-11(5-8)19-7-18-10/h1-5H,6-7H2,(H,15,20)InChIKey
RGXMQZXCZQLBNV-UHFFFAOYSA-NSynonyms
451468-89-63(13BENZODIOXOL5YLMETHYL)2SULFANYLIDENE1HTHIENO(32D)PYRIMIDIN4ONE
3(13benzodioxol5ylmethyl)2thioxo23dihydrothieno(32d)pyrimidin4(1H)one
451468896
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)NC3=S
InChI=1SC14H10N2O3S2c1713129(342112)1514(20)16(13)68121011(58)1971810h15H67H2(H1520)
MFCD03018410
S=c1(nH)c2ccsc2c(=O)n1Cc1ccc2c(c1)OCO2
ZINC000100021148
ZINC100021148
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