Vitas-M small molecule compound

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

Catalog ID
STL325269
SMILES COC(=O)c1cccc(c1)Nc1nc2ccccc2nc1n1nc(cc1C)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 C21H19N5O2 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O2/c1-13-11-14(2)26(25-13)20-19(23-17-9-4-5-10-18(17)24-20)22-16-8-6-7-15(12-16)21(27)28-3/h4-12H,1-3H3,(H,22,23)
InChIKey
MKYCWJOBXPRKNS-UHFFFAOYSA-N
Synonyms
312310-43-3
312310433
CC1=CC(=NN1C2=NC3=CC=CC=C3N=C2NC4=CC=CC(=C4)C(=O)OC)C
InChI=1SC21H19N5O2c1131114(2)26(2513)2019(23179451018(17)2420)221686715(1216)21(27)283h412H13H3(H2223)
methyl3((3(35dimethyl1Hpyrazol1yl)quinoxalin2yl)amino)benzoate
METHYL3((3(35DIMETHYLPYRAZOL1YL)QUINOXALIN2YL)AMINO)BENZOATE
MFCD01858491
ZINC000000985020
ZINC00985020
ZINC985020

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Available files

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