Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK283305
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CC(OCc1s2)C(C)C
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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 C27H25BrN2O4S2 MW 585.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O4S2/c1-15(2)22-12-20-23(13-34-22)36-25-24(20)26(32)30(18-8-10-19(33-3)11-9-18)27(29-25)35-14-21(31)16-4-6-17(28)7-5-16/h4-11,15,22H,12-14H2,1-3H3InChIKey
BHHOSSMFRZLTOI-UHFFFAOYSA-NSynonyms
2((2(4bromophenyl)2oxoethyl)sulfanyl)3(4methoxyphenyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2(4bromophenyl)2oxoethyl)thio)6isopropyl3(4methoxyphenyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2(2(4bromophenyl)2oxoethyl)sulfanyl3(4methoxyphenyl)6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin4one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)OC
InChI=1SC27H25BrN2O4S2c115(2)22122023(133422)362524(20)26(32)30(1881019(333)11918)27(2925)351421(31)164617(28)7516h4111522H1214H213H3
MFCD03006719
ZINC000001773644
ZINC000001773647
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