Vitas-M small molecule compound
1-(4-bromophenyl)-2-[(2,2-dimethyl-5-propyl-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
STK532022
SMILES CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)c1ccc(cc1)Br
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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/c1-4-5-18-17-11-31-25(2,3)10-16(17)20-21-22(33-23(20)29-18)24(28-13-27-21)32-12-19(30)14-6-8-15(26)9-7-14/h6-9,13H,4-5,10-12H2,1-3H3InChIKey
IJKYOUCJEMGUKA-UHFFFAOYSA-NSynonyms
1(4bromophenyl)2((22dimethyl5propyl14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)ethanone
1(4bromophenyl)2((22dimethyl5propyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)ethanone
CCCC1=C2COC(CC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=C(C=C5)Br)SC3=N1)(C)C
InChI=1SC25H24BrN3O2S2c1451817113125(23)1016(17)202122(3323(20)2918)24(28132721)321219(30)146815(26)9714h6913H451012H213H3
ZINC000002295301
ZINC2295301
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