Vitas-M small molecule compound
methyl 2-{[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}benzoate
Catalog ID
STL391998
SMILES COC(=O)c1ccccc1NC(=O)Cn1nc(c(c1C)Cl)[N+](=O)[O-]
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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 C14H13ClN4O5 MW 352.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClN4O5/c1-8-12(15)13(19(22)23)17-18(8)7-11(20)16-10-6-4-3-5-9(10)14(21)24-2/h3-6H,7H2,1-2H3,(H,16,20)InChIKey
YIJAJELRKQCPNB-UHFFFAOYSA-NSynonyms
353499-43-1353499431
CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2C(=O)OC)(N+)(=O)(O))Cl
COC(=O)c1ccccc1NC(=O)Cn1nc(c(c1C)Cl)(N+)(=O)(O)
InChI=1SC14H13ClN4O5c1812(15)13(19(22)23)1718(8)711(20)161064359(10)14(21)242h36H7H212H3(H1620)
methyl2(((4chloro5methyl3nitro1Hpyrazol1yl)acetyl)amino)benzoate
METHYL2((2(4CHLORO5METHYL3NITROPYRAZOL1YL)ACETYL)AMINO)BENZOATE
MFCD00292819
ZINC000000797421
ZINC00797421
ZINC797421
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