Vitas-M small molecule compound
1-[5-{[4-(benzyloxy)benzyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-3-methylbutan-1-one
Catalog ID
STK227655
SMILES CC(CC(=O)n1nc(nc1NCc1ccc(cc1)OCc1ccccc1)c1cccnc1)C
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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 C26H27N5O2 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2/c1-19(2)15-24(32)31-26(29-25(30-31)22-9-6-14-27-17-22)28-16-20-10-12-23(13-11-20)33-18-21-7-4-3-5-8-21/h3-14,17,19H,15-16,18H2,1-2H3,(H,28,29,30)InChIKey
QGKPZOFWTLNEAU-UHFFFAOYSA-NSynonyms
1(5((4(BENZYLOXY)BENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)3METHYLBUTAN1ONE
3methyl1(5((4phenylmethoxyphenyl)methylamino)3pyridin3yl124triazol1yl)butan1one
CC(C)CC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=C(C=C3)OCC4=CC=CC=C4
InChI=1SC26H27N5O2c119(2)1524(32)3126(2925(3031)229614271722)281620101223(131120)3318217435821h3141719H151618H212H3(H282930)
MFCD08671754
ZINC000009288874
ZINC09288874
ZINC9288874
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