Vitas-M small molecule compound
2-{4-[(2,3-dihydro-1H-inden-5-yloxy)methyl]phenyl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK309760
SMILES c1ccc(cc1)n1ncc2c1ncn1c2nc(n1)c1ccc(cc1)COc1ccc2c(c1)CCC2
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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 C28H22N6O MW 458.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N6O/c1-2-7-23(8-3-1)34-27-25(16-30-34)28-31-26(32-33(28)18-29-27)21-11-9-19(10-12-21)17-35-24-14-13-20-5-4-6-22(20)15-24/h1-3,7-16,18H,4-6,17H2InChIKey
WWWKRZNWOHRRKI-UHFFFAOYSA-NSynonyms
832115-39-62(4((23dihydro1Hinden5yloxy)methyl)phenyl)7phenyl7Hpyrazolo(43e)(124)triazolo(15c)pyrimidine
832115396
C1CC2=C(C1)C=C(C=C2)OCC3=CC=C(C=C3)C4=NN5C=NC6=C(C5=N4)C=NN6C7=CC=CC=C7
InChI=1SC28H22N6Oc12723(831)342725(163034)283126(3233(28)182927)2111919(101221)17352414132054622(20)1524h1371618H4617H2
MFCD04133851
ZINC000002802941
ZINC02802941
ZINC2802941
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