Vitas-M small molecule compound
6-(4-bromophenyl)-2-chloro-7-(4-methylphenyl)-10-(methylsulfanyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Catalog ID
STL041292
SMILES CSc1nn2c(n1)NC1=C(C2c2ccc(cc2)C)C(Oc2c1cc(Cl)cc2)c1ccc(cc1)Br
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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 C26H20BrClN4OS MW 551.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrClN4OS/c1-14-3-5-15(6-4-14)23-21-22(29-25-30-26(34-2)31-32(23)25)19-13-18(28)11-12-20(19)33-24(21)16-7-9-17(27)10-8-16/h3-13,23-24H,1-2H3,(H,29,30,31)InChIKey
JDMQNBAPPJYCOL-UHFFFAOYSA-NSynonyms
6(4bromophenyl)2chloro10(methylthio)7(ptolyl)712dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidine
6(4bromophenyl)2chloro7(4methylphenyl)10(methylsulfanyl)712dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidine
CC1=CC=C(C=C1)C2C3=C(C4=C(C=CC(=C4)Cl)OC3C5=CC=C(C=C5)Br)N=C6N2NC(=N6)SC
InChI=1SC26H20BrClN4OSc1143515(6414)232122(29253026(342)3132(23)25)191318(28)111220(19)3324(21)167917(27)10816h3132324H12H3(H293031)
MFCD03683768
ZINC000001877695
ZINC000002604915
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