Vitas-M small molecule compound
methyl 2-{[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK969010
SMILES COC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)[N+](=O)[O-])sc(c1C)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 C14H15BrN4O5S MW 431.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15BrN4O5S/c1-6-8(3)25-13(10(6)14(21)24-4)16-9(20)5-18-7(2)11(15)12(17-18)19(22)23/h5H2,1-4H3,(H,16,20)InChIKey
WSQWJZLORFWSSR-UHFFFAOYSA-NSynonyms
512827-70-2512827702
CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C(=C(C(=N2)(N+)(=O)(O))Br)C)C
COC(=O)c1c(NC(=O)Cn2nc(c(c2C)Br)(N+)(=O)(O))sc(c1C)C
InChI=1SC14H15BrN4O5Sc168(3)2513(10(6)14(21)244)169(20)5187(2)11(15)12(1718)19(22)23h5H214H3(H1620)
METHYL2(((4BROMO3NITRO5METHYL1HPYRAZOL1YL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
methyl2(((4bromo5methyl3nitro1Hpyrazol1yl)acetyl)amino)45dimethylthiophene3carboxylate
METHYL2((2(4BROMO5METHYL3NITROPYRAZOL1YL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02605415
ZINC000000995994
ZINC00995994
ZINC995994
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