Vitas-M small molecule compound
2-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK062540
SMILES O=c1[nH]c(nc2c1c1CCCCc1s2)c1ccc2c(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 C17H14N2O3S MW 326.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O3S/c20-16-14-10-3-1-2-4-13(10)23-17(14)19-15(18-16)9-5-6-11-12(7-9)22-8-21-11/h5-7H,1-4,8H2,(H,18,19,20)InChIKey
QTTROPWBMXSVPQ-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(13benzodioxol5yl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4=CC5=C(C=C4)OCO5
InChI=1SC17H14N2O3Sc20161410312413(10)2317(14)1915(1816)9561112(79)2282111h57H148H2(H181920)
MFCD01171094
O=c1(nH)c(nc2c1c1CCCCc1s2)c1ccc2c(c1)OCO2
STK062540
ZINC04094532
ZINC18116373
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