Vitas-M small molecule compound
methyl 7-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK323357
SMILES COC(=O)C1=C(Nc2n(C1c1ccc(c(c1)OC)OCc1ccccc1F)ncn2)c1ccccc1
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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 C27H23FN4O4 MW 486.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN4O4/c1-34-22-14-18(12-13-21(22)36-15-19-10-6-7-11-20(19)28)25-23(26(33)35-2)24(17-8-4-3-5-9-17)31-27-29-16-30-32(25)27/h3-14,16,25H,15H2,1-2H3,(H,29,30,31)InChIKey
ZPTYOUIDOPOONW-UHFFFAOYSA-NSynonyms
COC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C4=CC=CC=C4)C(=O)OC)OCC5=CC=CC=C5F
InChI=1SC27H23FN4O4c134221418(121321(22)36151910671120(19)28)2523(26(33)352)24(178435917)312729163032(25)27h3141625H15H212H3(H293031)
METHYL7(4((2FLUOROBENZYL)OXY)3METHOXYPHENYL)5PHENYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
METHYL7(4((2FLUOROPHENYL)METHOXY)3METHOXYPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
MFCD06002880
ZINC000001079654
ZINC000001079656
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