Vitas-M small molecule compound
2-chloro-7-(4-methoxyphenyl)-6-[4-(methylsulfanyl)phenyl]-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Catalog ID
STK593364
SMILES COc1ccc(cc1)C1C2=C(Nc3n1ncn3)c1c(OC2c2ccc(cc2)SC)ccc(c1)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 C26H21ClN4O2S MW 489.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4O2S/c1-32-18-8-3-15(4-9-18)24-22-23(30-26-28-14-29-31(24)26)20-13-17(27)7-12-21(20)33-25(22)16-5-10-19(34-2)11-6-16/h3-14,24-25H,1-2H3,(H,28,29,30)InChIKey
BXZVKVIABSWGMI-UHFFFAOYSA-NSynonyms
850230-54-52chloro7(4methoxyphenyl)6(4(methylsulfanyl)phenyl)712dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidine
2chloro7(4methoxyphenyl)6(4(methylthio)phenyl)712dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidine
850230545
COC1=CC=C(C=C1)C2C3=C(C4=C(C=CC(=C4)Cl)OC3C5=CC=C(C=C5)SC)N=C6N2NC=N6
InChI=1SC26H21ClN4O2Sc132188315(4918)242223(302628142931(24)26)201317(27)71221(20)3325(22)1651019(342)11616h3142425H12H3(H282930)
MFCD05691267
ZINC000009487433
ZINC000013556245
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