Vitas-M small molecule compound
2-[5-(3,4-difluorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-(4-phenoxyphenyl)acetamide
Catalog ID
STL081361
SMILES O=C(CN1N=NC2C1C(=O)N(C2=O)c1ccc(c(c1)F)F)Nc1ccc(cc1)Oc1ccccc1
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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 C24H17F2N5O4 MW 477.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F2N5O4/c25-18-11-8-15(12-19(18)26)31-23(33)21-22(24(31)34)30(29-28-21)13-20(32)27-14-6-9-17(10-7-14)35-16-4-2-1-3-5-16/h1-12,21-22H,13H2,(H,27,32)InChIKey
VBXJDNPYCLIYDI-UHFFFAOYSA-NSynonyms
1052608-02-21052608022
2(5(34difluorophenyl)46dioxo3a6adihydropyrrolo(34d)triazol3yl)N(4phenoxyphenyl)acetamide
2(5(34difluorophenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)N(4phenoxyphenyl)acetamide
C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CN3C4C(C(=O)N(C4=O)C5=CC(=C(C=C5)F)F)N=N3
InChI=1SC24H17F2N5O4c251811815(1219(18)26)3123(33)2122(24(31)34)30(292821)1320(32)27146917(10714)35164213516h1122122H13H2(H2732)
MFCD07655909
ZINC000009675247
ZINC000101169080
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