Vitas-M small molecule compound
1-(4-bromophenyl)-2-{[5-(furan-2-yl)-2,2-dimethyl-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
STK567242
SMILES Brc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1
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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 C26H20BrN3O3S2 MW 566.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrN3O3S2/c1-26(2)10-16-17(11-33-26)21(19-4-3-9-32-19)30-24-20(16)22-23(35-24)25(29-13-28-22)34-12-18(31)14-5-7-15(27)8-6-14/h3-9,13H,10-12H2,1-2H3InChIKey
BXKKXPPUNIZGEY-UHFFFAOYSA-NSynonyms
1(4bromophenyl)2((5(furan2yl)22dimethyl14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)ethanone
1(4bromophenyl)2((5(furan2yl)22dimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)ethanone
CC1(CC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=C(C=C5)Br)SC3=NC(=C2CO1)C6=CC=CO6)C
InChI=1SC26H20BrN3O3S2c126(2)101617(113326)21(194393219)302420(16)2223(3524)25(29132822)341218(31)145715(27)8614h3913H1012H212H3
ZINC000001758186
ZINC01758186
ZINC1758186
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