Vitas-M small molecule compound

methyl 4-{[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)carbonyl]amino}benzoate

Catalog ID
STK330326
SMILES COC(=O)c1ccc(cc1)NC(=O)c1c(C)nn(c1Cl)c1ccccc1

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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 C19H16ClN3O3 MW 369.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O3/c1-12-16(17(20)23(22-12)15-6-4-3-5-7-15)18(24)21-14-10-8-13(9-11-14)19(25)26-2/h3-11H,1-2H3,(H,21,24)
InChIKey
BINICBNYAMHFFK-UHFFFAOYSA-N
Synonyms

CC1=NN(C(=C1C(=O)NC2=CC=C(C=C2)C(=O)OC)Cl)C3=CC=CC=C3
InChI=1SC19H16ClN3O3c11216(17(20)23(2212)156435715)18(24)211410813(91114)19(25)262h311H12H3(H2124)
methyl4(((5chloro3methyl1phenyl1Hpyrazol4yl)carbonyl)amino)benzoate
METHYL4((5CHLORO3METHYL1PHENYLPYRAZOLE4CARBONYL)AMINO)BENZOATE
methyl4(5chloro3methyl1phenyl1Hpyrazole4carboxamido)benzoate
MFCD00850866
ZINC000002284824
ZINC02284824
ZINC2284824

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Available files

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