Vitas-M small molecule compound
1-(4-bromophenyl)-2-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}ethanone
Catalog ID
STK532116
SMILES Brc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)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 C25H24BrN3O2S2 MW 542.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O2S2/c1-13(2)20-17-10-31-25(3,4)9-16(17)19-21-22(33-23(19)29-20)24(28-12-27-21)32-11-18(30)14-5-7-15(26)8-6-14/h5-8,12-13H,9-11H2,1-4H3InChIKey
BVNPQCFZZLWSDY-UHFFFAOYSA-NSynonyms
1(4bromophenyl)2((22dimethyl5(propan2yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)ethanone
1(4bromophenyl)2((5isopropyl22dimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)ethanone
CC(C)C1=C2COC(CC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=C(C=C5)Br)SC3=N1)(C)C
InChI=1SC25H24BrN3O2S2c113(2)2017103125(34)916(17)192122(3323(19)2920)24(28122721)321118(30)145715(26)8614h581213H911H214H3
ZINC000002292011
ZINC2292011
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