Vitas-M small molecule compound
2-[(3-butyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL093853
SMILES CCCCn1c(SCC(=O)N)nc2c(c1=O)[nH]c(c2)C
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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 C13H18N4O2S MW 294.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O2S/c1-3-4-5-17-12(19)11-9(6-8(2)15-11)16-13(17)20-7-10(14)18/h6,15H,3-5,7H2,1-2H3,(H2,14,18)InChIKey
CIGVLIJLLDIXGC-UHFFFAOYSA-NSynonyms
2((3butyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
2((3butyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
CCCCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)N
CCCCn1c(SCC(=O)N)nc2c(c1=O)(nH)c(c2)C
InChI=1SC13H18N4O2Sc13451712(19)119(68(2)1511)1613(17)20710(14)18h615H357H212H3(H21418)
MFCD18787987
ZINC000067239311
ZINC67239311
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