Vitas-M small molecule compound
3-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK744025
SMILES Brc1cc2OCOc2cc1Cn1cnc2c(c1=O)c1CCCc1s2
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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 C17H13BrN2O3S MW 405.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN2O3S/c18-11-5-13-12(22-8-23-13)4-9(11)6-20-7-19-16-15(17(20)21)10-2-1-3-14(10)24-16/h4-5,7H,1-3,6,8H2InChIKey
SYHPHQQASXLHNI-UHFFFAOYSA-NSynonyms
2((6bromo13benzodioxol5yl)methyl)78dihydro6Hcyclopenta(23)thieno(24d)pyrimidin1one
3((6bromo13benzodioxol5yl)methyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
C1CC2=C(C1)SC3=C2C(=O)N(C=N3)CC4=CC5=C(C=C4Br)OCO5
InChI=1SC17H13BrN2O3Sc181151312(2282313)49(11)6207191615(17(20)21)1021314(10)2416h457H1368H2
MFCD06618592
ZINC000004751610
ZINC04751610
ZINC4751610
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