Vitas-M small molecule compound
N-(3-chloro-4-fluorophenyl)-2-[5-(3,4-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetamide
Catalog ID
STL081371
SMILES O=C(CN1N=NC2C1C(=O)N(C2=O)c1ccc(c(c1)C)C)Nc1ccc(c(c1)Cl)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 C20H17ClFN5O3 MW 429.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClFN5O3/c1-10-3-5-13(7-11(10)2)27-19(29)17-18(20(27)30)26(25-24-17)9-16(28)23-12-4-6-15(22)14(21)8-12/h3-8,17-18H,9H2,1-2H3,(H,23,28)InChIKey
GWYXAYIZWQSYFJ-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=O)C3C(C2=O)N(N=N3)CC(=O)NC4=CC(=C(C=C4)F)Cl)C
InChI=1SC20H17ClFN5O3c1103513(711(10)2)2719(29)1718(20(27)30)26(252417)916(28)23124615(22)14(21)812h381718H9H212H3(H2328)
MFCD14749809
N(3chloro4fluorophenyl)2(5(34dimethylphenyl)46dioxo3a6adihydropyrrolo(34d)triazol3yl)acetamide
N(3chloro4fluorophenyl)2(5(34dimethylphenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)acetamide
ZINC000009675281
ZINC000101389304
Check stock
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