Vitas-M small molecule compound
1-[4-(4-fluorophenyl)piperazin-1-yl]-2-{[7-(4-methoxyphenyl)-5H-pyrrolo[3,2-d]pyrimidin-4-yl]sulfanyl}ethanone
Catalog ID
STL144367
SMILES COc1ccc(cc1)c1c[nH]c2c1ncnc2SCC(=O)N1CCN(CC1)c1ccc(cc1)F
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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 C25H24FN5O2S MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN5O2S/c1-33-20-8-2-17(3-9-20)21-14-27-24-23(21)28-16-29-25(24)34-15-22(32)31-12-10-30(11-13-31)19-6-4-18(26)5-7-19/h2-9,14,16,27H,10-13,15H2,1H3InChIKey
HJPNOSBJERGBEC-UHFFFAOYSA-NSynonyms
1111175-47-31(4(4fluorophenyl)piperazin1yl)2((7(4methoxyphenyl)5Hpyrrolo(32d)pyrimidin4yl)sulfanyl)ethanone
1111175473
4((2(4(4FLUOROPHENYL)PIPERAZIN1YL)2OXOETHYL)THIO)7(4METHOXYPHENYL)5HPYRROLO(32D)PYRIMIDINE
COC1=CC=C(C=C1)C2=CNC3=C2N=CN=C3SCC(=O)N4CCN(CC4)C5=CC=C(C=C5)F
COc1ccc(cc1)c1c(nH)c2c1ncnc2SCC(=O)N1CCN(CC1)c1ccc(cc1)F
InChI=1SC25H24FN5O2Sc133208217(3920)2114272423(21)28162925(24)341522(32)31121030(111331)196418(26)5719h29141627H101315H21H3
MFCD15137662
ZINC000033169973
ZINC33169973
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