Vitas-M small molecule compound
diethyl 1-{2-[3-(4-chlorophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL175909
SMILES CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)N1N=C(CC1c1ccc(cc1)OC)c1ccc(cc1)Cl
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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 C26H26ClN5O6 MW 539.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5O6/c1-4-37-25(34)23-24(26(35)38-5-2)31(30-28-23)15-22(33)32-21(17-8-12-19(36-3)13-9-17)14-20(29-32)16-6-10-18(27)11-7-16/h6-13,21H,4-5,14-15H2,1-3H3InChIKey
JTLIZJSOVKBDRU-UHFFFAOYSA-NSynonyms
438228-89-8438228898
CCOC(=O)C1=C(N(N=N1)CC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC)C(=O)OCC
diethyl1(2(3(4chlorophenyl)5(4methoxyphenyl)45dihydro1Hpyrazol1yl)2oxoethyl)1H123triazole45dicarboxylate
DIETHYL1(2(5(4CHLOROPHENYL)3(4METHOXYPHENYL)34DIHYDROPYRAZOL2YL)2OXOETHYL)TRIAZOLE45DICARBOXYLATE
InChI=1SC26H26ClN5O6c143725(34)2324(26(35)3852)31(302823)1522(33)3221(1781219(363)13917)1420(2932)1661018(27)11716h61321H451415H213H3
MFCD03466762
ZINC000000651291
ZINC000000651293
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