Vitas-M small molecule compound
2-[5-(3,4-dimethoxyphenyl)-1-(phenylcarbonyl)-4,5-dihydro-1H-pyrazol-3-yl]naphthalen-1-yl benzoate
Catalog ID
STL069614
SMILES COc1cc(ccc1OC)C1CC(=NN1C(=O)c1ccccc1)c1ccc2c(c1OC(=O)c1ccccc1)cccc2
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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 C35H28N2O5 MW 556.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H28N2O5/c1-40-31-20-18-26(21-32(31)41-2)30-22-29(36-37(30)34(38)24-12-5-3-6-13-24)28-19-17-23-11-9-10-16-27(23)33(28)42-35(39)25-14-7-4-8-15-25/h3-21,30H,22H2,1-2H3InChIKey
SNNWEIBJXWPGQD-UHFFFAOYSA-NSynonyms
(2(2BENZOYL3(34DIMETHOXYPHENYL)34DIHYDROPYRAZOL5YL)NAPHTHALEN1YL)BENZOATE
2(1benzoyl5(34dimethoxyphenyl)45dihydro1Hpyrazol3yl)naphthalen1ylbenzoate
2(5(34dimethoxyphenyl)1(phenylcarbonyl)45dihydro1Hpyrazol3yl)naphthalen1ylbenzoate
COC1=C(C=C(C=C1)C2CC(=NN2C(=O)C3=CC=CC=C3)C4=C(C5=CC=CC=C5C=C4)OC(=O)C6=CC=CC=C6)OC
InChI=1SC35H28N2O5c14031201826(2132(31)412)302229(3637(30)34(38)24125361324)28191723119101627(23)33(28)4235(39)25147481525h32130H22H212H3
MFCD03670045
ZINC000102816156
ZINC000102816158
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