Vitas-M small molecule compound

methyl 2-{[(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]amino}benzoate

Catalog ID
STK685885
SMILES COC(=O)c1ccccc1NC(=O)Cn1nc(c(c1C)I)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 C15H16IN3O3 MW 413.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16IN3O3/c1-9-14(16)10(2)19(18-9)8-13(20)17-12-7-5-4-6-11(12)15(21)22-3/h4-7H,8H2,1-3H3,(H,17,20)
InChIKey
ZHJPAELOGYSPAZ-UHFFFAOYSA-N
Synonyms

CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2C(=O)OC)C)I
InChI=1SC15H16IN3O3c1914(16)10(2)19(189)813(20)1712754611(12)15(21)223h47H8H213H3(H1720)
methyl2(((4iodo35dimethyl1Hpyrazol1yl)acetyl)amino)benzoate
METHYL2((2(4IODO35DIMETHYLPYRAZOL1YL)ACETYL)AMINO)BENZOATE
MFCD06013696
ZINC000001432176
ZINC01432176
ZINC1432176

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.