Vitas-M small molecule compound
2-[(3-butyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
Catalog ID
STL093684
SMILES CCCCn1c(SCC(=O)Nc2ccccc2F)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 C19H21FN4O2S MW 388.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21FN4O2S/c1-3-4-9-24-18(26)17-15(10-12(2)21-17)23-19(24)27-11-16(25)22-14-8-6-5-7-13(14)20/h5-8,10,21H,3-4,9,11H2,1-2H3,(H,22,25)InChIKey
QUCWKDSDIGQEBP-UHFFFAOYSA-NSynonyms
2((3butyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2fluorophenyl)acetamide
2((3butyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2fluorophenyl)acetamide
CCCCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NC3=CC=CC=C3F
CCCCn1c(SCC(=O)Nc2ccccc2F)nc2c(c1=O)(nH)c(c2)C
InChI=1SC19H21FN4O2Sc13492418(26)1715(1012(2)2117)2319(24)271116(25)2214865713(14)20h581021H34911H212H3(H2225)
MFCD18787818
ZINC000067238412
ZINC67238412
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