Vitas-M small molecule compound
4-chloro-2-[5-(3,4-dimethoxyphenyl)-1-(phenylcarbonyl)-4,5-dihydro-1H-pyrazol-3-yl]phenyl benzoate
Catalog ID
STK731203
SMILES COc1cc(ccc1OC)C1CC(=NN1C(=O)c1ccccc1)c1cc(Cl)ccc1OC(=O)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 C31H25ClN2O5 MW 541.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25ClN2O5/c1-37-28-15-13-22(17-29(28)38-2)26-19-25(33-34(26)30(35)20-9-5-3-6-10-20)24-18-23(32)14-16-27(24)39-31(36)21-11-7-4-8-12-21/h3-18,26H,19H2,1-2H3InChIKey
LFEXMIWLURXDGC-UHFFFAOYSA-NSynonyms
577990-37-5(2(2BENZOYL3(34DIMETHOXYPHENYL)34DIHYDROPYRAZOL5YL)4CHLOROPHENYL)BENZOATE
2(1BENZOYL5(34DIMETHOXYPHENYL)45DIHYDRO1HPYRAZOL3YL)4CHLOROPHENYLBENZOATE
4chloro2(5(34dimethoxyphenyl)1(phenylcarbonyl)45dihydro1Hpyrazol3yl)phenylbenzoate
577990375
COC1=C(C=C(C=C1)C2CC(=NN2C(=O)C3=CC=CC=C3)C4=C(C=CC(=C4)Cl)OC(=O)C5=CC=CC=C5)OC
InChI=1SC31H25ClN2O5c13728151322(1729(28)382)261925(3334(26)30(35)2095361020)241823(32)141627(24)3931(36)21117481221h31826H19H212H3
MFCD04022398
ZINC000097953153
ZINC000097953154
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