Vitas-M small molecule compound
ethyl 7-[4-(benzyloxy)-3-methoxyphenyl]-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK130867
SMILES CCOC(=O)C1=C(Nc2n(C1c1ccc(c(c1)OC)OCc1ccccc1)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 C28H26N4O4 MW 482.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O4/c1-3-35-27(33)24-25(20-12-8-5-9-13-20)31-28-29-18-30-32(28)26(24)21-14-15-22(23(16-21)34-2)36-17-19-10-6-4-7-11-19/h4-16,18,26H,3,17H2,1-2H3,(H,29,30,31)InChIKey
BDYNHGNHPSUSGT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N=CNN2C1C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C5=CC=CC=C5
ETHYL7(3METHOXY4PHENYLMETHOXYPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7(4(BENZYLOXY)3METHOXYPHENYL)5PHENYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H26N4O4c133527(33)2425(20128591320)312829183032(28)26(24)21141522(23(1621)342)361719106471119h4161826H317H212H3(H293031)
MFCD02971611
ZINC000001418602
ZINC000001418603
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