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-(2-methylphenyl)acetamide
Catalog ID
STL081340
SMILES O=C(Nc1ccccc1C)CN1N=NC2C1C(=O)N(C2=O)c1ccc(c(c1)F)F
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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 C19H15F2N5O3 MW 399.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15F2N5O3/c1-10-4-2-3-5-14(10)22-15(27)9-25-17-16(23-24-25)18(28)26(19(17)29)11-6-7-12(20)13(21)8-11/h2-8,16-17H,9H2,1H3,(H,22,27)InChIKey
DNNJYDDCEXLWQQ-UHFFFAOYSA-NSynonyms
1009274-48-91009274489
2(5(34difluorophenyl)46dioxo3a6adihydropyrrolo(34d)triazol3yl)N(2methylphenyl)acetamide
2(5(34difluorophenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)N(2methylphenyl)acetamide
CC1=CC=CC=C1NC(=O)CN2C3C(C(=O)N(C3=O)C4=CC(=C(C=C4)F)F)N=N2
InChI=1SC19H15F2N5O3c110423514(10)2215(27)9251716(232425)18(28)26(19(17)29)116712(20)13(21)811h281617H9H21H3(H2227)
MFCD07655899
ZINC000004483976
ZINC000101168995
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