Vitas-M small molecule compound
2-{[2,2-dimethyl-10-(methylsulfanyl)-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}-1-phenylethanone
Catalog ID
STL304451
SMILES CSc1nc(SCC(=O)c2ccccc2)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)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 C26H27N3O2S3 MW 509.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O2S3/c1-14(2)20-17-12-31-26(3,4)11-16(17)19-21-22(34-23(19)27-20)24(29-25(28-21)32-5)33-13-18(30)15-9-7-6-8-10-15/h6-10,14H,11-13H2,1-5H3InChIKey
JZSAJIJOSGIMBP-UHFFFAOYSA-NSynonyms
845902-95-62((22dimethyl10(methylsulfanyl)5(propan2yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1phenylethanone
2((5isopropyl22dimethyl10(methylthio)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)1phenylethanone
845902956
CC(C)C1=C2COC(CC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)C5=CC=CC=C5)SC3=N1)(C)C
InChI=1SC26H27N3O2S3c114(2)2017123126(34)1116(17)192122(3423(19)2720)24(2925(2821)325)331318(30)1597681015h61014H1113H215H3
MFCD04173217
ZINC000002408268
ZINC02408268
ZINC2408268
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