Vitas-M small molecule compound
1-(4-bromophenyl)-2-[(10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]ethanone
Catalog ID
STK554360
SMILES Brc1ccc(cc1)C(=O)CSc1nnc2n1cnc1c2sc2c1c1CCCc1c(n2)c1ccccc1
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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 C27H18BrN5OS2 MW 572.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18BrN5OS2/c28-17-11-9-15(10-12-17)20(34)13-35-27-32-31-25-24-23(29-14-33(25)27)21-18-7-4-8-19(18)22(30-26(21)36-24)16-5-2-1-3-6-16/h1-3,5-6,9-12,14H,4,7-8,13H2InChIKey
QHQGXHZHOJYRGE-UHFFFAOYSA-NSynonyms
1(4bromophenyl)2((10phenyl89dihydro7Hcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)ethanone
1(4bromophenyl)2((10phenyl89dihydro7Hcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidin3yl)thio)ethanone
C1CC2=C3C4=C(C5=NN=C(N5C=N4)SCC(=O)C6=CC=C(C=C6)Br)SC3=NC(=C2C1)C7=CC=CC=C7
InChI=1SC27H18BrN5OS2c281711915(101217)20(34)1335273231252423(291433(25)27)211874819(18)22(3026(21)3624)165213616h135691214H47813H2
MFCD04005616
ZINC000002593301
ZINC2593301
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