Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK086226
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCCc1s2
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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 C24H19BrN2O3S2 MW 527.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN2O3S2/c1-30-17-11-9-16(10-12-17)27-23(29)21-18-3-2-4-20(18)32-22(21)26-24(27)31-13-19(28)14-5-7-15(25)8-6-14/h5-12H,2-4,13H2,1H3InChIKey
LNWGDRZJZDCSGN-UHFFFAOYSA-NSynonyms
364619-23-82((2(4bromophenyl)2oxoethyl)sulfanyl)3(4methoxyphenyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
2((2(4bromophenyl)2oxoethyl)thio)3(4methoxyphenyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
3(2(4bromophenyl)2oxoethyl)sulfanyl2(4methoxyphenyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
364619238
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=C(C=C4)Br)SC5=C3CCC5
COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCCc1s2
InChI=1SC24H19BrN2O3S2c1301711916(101217)2723(29)211832420(18)3222(21)2624(27)311319(28)145715(25)8614h512H2413H21H3
MFCD01564084
STK086226
ZINC000002183135
ZINC02183135
ZINC2183135
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