Vitas-M small molecule compound
methyl 4-[7-(4-methoxyphenyl)-7,11-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]benzoate
Catalog ID
STK645146
SMILES COc1ccc(cc1)C1C2=C(N=c3n1nc[nH]3)c1c(OC2c2ccc(cc2)C(=O)OC)cccc1
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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 C27H22N4O4 MW 466.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O4/c1-33-19-13-11-16(12-14-19)24-22-23(30-27-28-15-29-31(24)27)20-5-3-4-6-21(20)35-25(22)17-7-9-18(10-8-17)26(32)34-2/h3-15,24-25H,1-2H3,(H,28,29,30)InChIKey
ZCPXEGOKYXYPQK-UHFFFAOYSA-NSynonyms
850186-20-8850186208
COC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4OC3C5=CC=C(C=C5)C(=O)OC)N=C6N2NC=N6
COc1ccc(cc1)C1C2=C(N=c3n1nc(nH)3)c1c(OC2c2ccc(cc2)C(=O)OC)cccc1
InChI=1SC27H22N4O4c13319131116(121419)242223(302728152931(24)27)20534621(20)3525(22)177918(10817)26(32)342h3152425H12H3(H282930)
methyl4(7(4methoxyphenyl)711dihydro6Hchromeno(43d)(124)triazolo(15a)pyrimidin6yl)benzoate
MFCD18163843
ZINC000002231585
ZINC000002231588
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