Vitas-M small molecule compound
3-(2-fluorobenzyl)-2-({2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL029458
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)CSc1nc2ccsc2c(=O)n1Cc1ccccc1F
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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 C26H25FN4O3S2 MW 524.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN4O3S2/c1-34-20-8-6-19(7-9-20)29-11-13-30(14-12-29)23(32)17-36-26-28-22-10-15-35-24(22)25(33)31(26)16-18-4-2-3-5-21(18)27/h2-10,15H,11-14,16-17H2,1H3InChIKey
CCZYHHWGOSXISR-UHFFFAOYSA-NSynonyms
3((2fluorophenyl)methyl)2(2(4(4methoxyphenyl)piperazin1yl)2oxoethyl)sulfanylthieno(32d)pyrimidin4one
3(2fluorobenzyl)2((2(4(4methoxyphenyl)piperazin1yl)2oxoethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC4=C(C(=O)N3CC5=CC=CC=C5F)SC=C4
InChI=1SC26H25FN4O3S2c134208619(7920)29111330(141229)23(32)173626282210153524(22)25(33)31(26)1618423521(18)27h21015H11141617H21H3
MFCD18189752
ZINC000067689915
ZINC67689915
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