Vitas-M small molecule compound
6-(2,6-dichlorobenzyl)-2-(furan-2-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
STK645035
SMILES Clc1cccc(c1Cn1c2sc3c(c2c2n(c1=O)nc(n2)c1ccco1)CCC3)Cl
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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 C21H14Cl2N4O2S MW 457.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14Cl2N4O2S/c22-13-5-2-6-14(23)12(13)10-26-20-17(11-4-1-8-16(11)30-20)19-24-18(15-7-3-9-29-15)25-27(19)21(26)28/h2-3,5-7,9H,1,4,8,10H2InChIKey
YXGYERFHIOMUFY-UHFFFAOYSA-NSynonyms
951961-48-16(26dichlorobenzyl)2(furan2yl)68910tetrahydro5Hcyclopenta(45)thieno(32e)(124)triazolo(15c)pyrimidin5one
951961481
C1CC2=C(C1)SC3=C2C4=NC(=NN4C(=O)N3CC5=C(C=CC=C5Cl)Cl)C6=CC=CO6
InChI=1SC21H14Cl2N4O2Sc221352614(23)12(13)10262017(1141816(11)3020)192418(157392915)2527(19)21(26)28h23579H14810H2
MFCD09851314
ZINC000013689873
ZINC13689873
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