Vitas-M small molecule compound

methyl 1-{[4-chloro-3,5-bis(4-methylphenyl)-1H-pyrazol-1-yl]methyl}-1H-pyrazole-3-carboxylate

Catalog ID
STL413550
SMILES COC(=O)c1ccn(n1)Cn1nc(c(c1c1ccc(cc1)C)Cl)c1ccc(cc1)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 C23H21ClN4O2 MW 420.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O2/c1-15-4-8-17(9-5-15)21-20(24)22(18-10-6-16(2)7-11-18)28(26-21)14-27-13-12-19(25-27)23(29)30-3/h4-13H,14H2,1-3H3
InChIKey
FFQBQOCOMKIGGD-UHFFFAOYSA-N
Synonyms
1006340-55-1
1006340551
CC1=CC=C(C=C1)C2=C(C(=NN2CN3C=CC(=N3)C(=O)OC)C4=CC=C(C=C4)C)Cl
InChI=1SC23H21ClN4O2c1154817(9515)2120(24)22(1810616(2)71118)28(2621)1427131219(2527)23(29)303h413H14H213H3
methyl1((4chloro35bis(4methylphenyl)1Hpyrazol1yl)methyl)1Hpyrazole3carboxylate
methyl1((4chloro35bis(4methylphenyl)pyrazol1yl)methyl)pyrazole3carboxylate
MFCD08552324
ZINC000036611276
ZINC36611276

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Available files

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