Vitas-M small molecule compound
2-{[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK721386
SMILES CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)c1ccccc1)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 C25H25N3OS2 MW 447.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3OS2/c1-15(2)12-19-17-10-6-7-11-18(17)21-22-23(31-24(21)28-19)25(27-14-26-22)30-13-20(29)16-8-4-3-5-9-16/h3-5,8-9,14-15H,6-7,10-13H2,1-2H3InChIKey
MDFLPEWZIZSSMV-UHFFFAOYSA-NSynonyms
371233-79-32((5(2methylpropyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)1phenylethanone
2((5isobutyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)1phenylethanone
371233793
CC(C)CC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=O)C5=CC=CC=C5)SC3=N1
InChI=1SC25H25N3OS2c115(2)12191710671118(17)212223(3124(21)2819)25(27142622)301320(29)168435916h35891415H671013H212H3
MFCD03006820
ZINC000001754355
ZINC01754355
ZINC1754355
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