Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL049448
SMILES CCOc1ccc(cc1)n1c(SCC(=O)c2ccc(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 C26H23BrN2O3S2 MW 555.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O3S2/c1-2-32-19-13-11-18(12-14-19)29-25(31)23-20-5-3-4-6-22(20)34-24(23)28-26(29)33-15-21(30)16-7-9-17(27)10-8-16/h7-14H,2-6,15H2,1H3InChIKey
MLSSLHCNWLOPBM-UHFFFAOYSA-NSynonyms
497240-79-62((2(4bromophenyl)2oxoethyl)sulfanyl)3(4ethoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((2(4bromophenyl)2oxoethyl)thio)3(4ethoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2(2(4bromophenyl)2oxoethyl)sulfanyl3(4ethoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
497240796
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=C(C=C4)Br)SC5=C3CCCC5
InChI=1SC26H23BrN2O3S2c123219131118(121419)2925(31)2320534622(20)3424(23)2826(29)331521(30)167917(27)10816h714H2615H21H3
MFCD03224583
ZINC000001871471
ZINC01871471
ZINC1871471
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