Vitas-M small molecule compound

1-[5-{[4-(benzyloxy)benzyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]-2-methylpropan-1-one

Catalog ID
STK227653
SMILES O=C(n1nc(nc1NCc1ccc(cc1)OCc1ccccc1)c1cccnc1)C(C)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 C25H25N5O2 MW 427.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2/c1-18(2)24(31)30-25(28-23(29-30)21-9-6-14-26-16-21)27-15-19-10-12-22(13-11-19)32-17-20-7-4-3-5-8-20/h3-14,16,18H,15,17H2,1-2H3,(H,27,28,29)
InChIKey
DCIGJUVZQVTHPB-UHFFFAOYSA-N
Synonyms

1(5((4(BENZYLOXY)BENZYL)AMINO)3(PYRIDIN3YL)1H124TRIAZOL1YL)2METHYLPROPAN1ONE
2methyl1(5((4phenylmethoxyphenyl)methylamino)3pyridin3yl124triazol1yl)propan1one
CC(C)C(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=C(C=C3)OCC4=CC=CC=C4
InChI=1SC25H25N5O2c118(2)24(31)3025(2823(2930)219614261621)271519101222(131119)3217207435820h3141618H1517H212H3(H272829)
MFCD08671753
ZINC000009288871
ZINC09288871
ZINC9288871

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Available files

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