Vitas-M small molecule compound
methyl (2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl)acetate
Catalog ID
STK354796
SMILES COC(=O)Cn1c(=O)[nH]c2c(c1=O)c1CCCCc1s2
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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 C13H14N2O4S MW 294.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O4S/c1-19-9(16)6-15-12(17)10-7-4-2-3-5-8(7)20-11(10)14-13(15)18/h2-6H2,1H3,(H,14,18)InChIKey
KBFZUYFLRUULSX-UHFFFAOYSA-NSynonyms
COC(=O)Cn1c(=O)(nH)c2c(c1=O)c1CCCCc1s2
COC(=O)CN1C(=O)C2=C(NC1=O)SC3=C2CCCC3
InChI=1SC13H14N2O4Sc1199(16)61512(17)10742358(7)2011(10)1413(15)18h26H21H3(H1418)
methyl(24dioxo145678hexahydro(1)benzothieno(23d)pyrimidin3(2H)yl)acetate
methyl2(24dioxo5678tetrahydro1H(1)benzothiolo(23d)pyrimidin3yl)acetate
MFCD11851853
ZINC000020100261
ZINC20100261
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