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-(4-chlorophenyl)ethyl]acetamide
Catalog ID
STL093704
SMILES CCCCn1c(SCC(=O)NCCc2ccc(cc2)Cl)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 C21H25ClN4O2S MW 432.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN4O2S/c1-3-4-11-26-20(28)19-17(12-14(2)24-19)25-21(26)29-13-18(27)23-10-9-15-5-7-16(22)8-6-15/h5-8,12,24H,3-4,9-11,13H2,1-2H3,(H,23,27)InChIKey
FWIQKWXXVGLVCQ-UHFFFAOYSA-NSynonyms
2((3butyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2(4chlorophenyl)ethyl)acetamide
2((3butyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2(4chlorophenyl)ethyl)acetamide
CCCCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NCCC3=CC=C(C=C3)Cl
CCCCn1c(SCC(=O)NCCc2ccc(cc2)Cl)nc2c(c1=O)(nH)c(c2)C
InChI=1SC21H25ClN4O2Sc134112620(28)1917(1214(2)2419)2521(26)291318(27)23109155716(22)8615h581224H3491113H212H3(H2327)
MFCD18787838
ZINC000067238479
ZINC67238479
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