Vitas-M small molecule compound
N-(4-acetylphenyl)-2-[5-(3-bromophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetamide
Catalog ID
STK305166
SMILES O=C(CN1N=NC2C1C(=O)N(C2=O)c1cccc(c1)Br)Nc1ccc(cc1)C(=O)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 C20H16BrN5O4 MW 470.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN5O4/c1-11(27)12-5-7-14(8-6-12)22-16(28)10-25-18-17(23-24-25)19(29)26(20(18)30)15-4-2-3-13(21)9-15/h2-9,17-18H,10H2,1H3,(H,22,28)InChIKey
YKBYLLJCTOVQHU-UHFFFAOYSA-NSynonyms
1024311-17-81024311178
CC(=O)C1=CC=C(C=C1)NC(=O)CN2C3C(C(=O)N(C3=O)C4=CC(=CC=C4)Br)N=N2
InChI=1SC20H16BrN5O4c111(27)125714(8612)2216(28)10251817(232425)19(29)26(20(18)30)1542313(21)915h291718H10H21H3(H2228)
MFCD04049981
N(4ACETYLPHENYL)2(5(3BROMOPHENYL)46DIOXO3A6ADIHYDROPYRROLO(34D)TRIAZOL3YL)ACETAMIDE
N(4acetylphenyl)2(5(3bromophenyl)46dioxo4566atetrahydropyrrolo(34d)(123)triazol1(3aH)yl)acetamide
ZINC000002785064
ZINC000102000293
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