Vitas-M small molecule compound
6-(4-bromobenzyl)-2-(pyridin-3-yl)-6,8,9,10-tetrahydro-5H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Catalog ID
STK941445
SMILES Brc1ccc(cc1)Cn1c2sc3c(c2c2n(c1=O)nc(n2)c1cccnc1)CCC3
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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 C22H16BrN5OS MW 478.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN5OS/c23-15-8-6-13(7-9-15)12-27-21-18(16-4-1-5-17(16)30-21)20-25-19(26-28(20)22(27)29)14-3-2-10-24-11-14/h2-3,6-11H,1,4-5,12H2InChIKey
WIIVGXVAWRXOQS-UHFFFAOYSA-NSynonyms
951979-09-26(4bromobenzyl)2(pyridin3yl)68910tetrahydro5Hcyclopenta(45)thieno(32e)(124)triazolo(15c)pyrimidin5one
951979092
C1CC2=C(C1)SC3=C2C4=NC(=NN4C(=O)N3CC5=CC=C(C=C5)Br)C6=CN=CC=C6
InChI=1SC22H16BrN5OSc23158613(7915)12272118(1641517(16)3021)202519(2628(20)22(27)29)143210241114h23611H14512H2
MFCD09854690
ZINC000013719727
ZINC13719727
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