Vitas-M small molecule compound
2-[(4-bromobenzyl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK011407
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CCCCc1s2
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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 C24H21BrN2O2S2 MW 513.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrN2O2S2/c1-29-18-12-10-17(11-13-18)27-23(28)21-19-4-2-3-5-20(19)31-22(21)26-24(27)30-14-15-6-8-16(25)9-7-15/h6-13H,2-5,14H2,1H3InChIKey
DDBXXPJDZSFWSQ-UHFFFAOYSA-NSynonyms
477332-86-82((4bromobenzyl)sulfanyl)3(4methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((4bromobenzyl)thio)3(4methoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2((4bromophenyl)methylsulfanyl)3(4methoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
477332868
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=C(C=C4)Br)SC5=C3CCCC5
COc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nc2c(c1=O)c1CCCCc1s2
InChI=1SC24H21BrN2O2S2c12918121017(111318)2723(28)2119423520(19)3122(21)2624(27)3014156816(25)9715h613H2514H21H3
MFCD03473815
STK011407
ZINC000001766322
ZINC01766322
ZINC1766322
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