Vitas-M small molecule compound
diethyl 1-{2-[3-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL175908
SMILES CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)N1N=C(CC1c1ccccc1)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 C25H24ClN5O5 MW 509.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN5O5/c1-3-35-24(33)22-23(25(34)36-4-2)30(29-27-22)15-21(32)31-20(17-8-6-5-7-9-17)14-19(28-31)16-10-12-18(26)13-11-16/h5-13,20H,3-4,14-15H2,1-2H3InChIKey
LJJBDEJUJHJDNB-UHFFFAOYSA-NSynonyms
438227-81-7438227817
CCOC(=O)C1=C(N(N=N1)CC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C(=O)OCC
diethyl1(2(3(4chlorophenyl)5phenyl45dihydro1Hpyrazol1yl)2oxoethyl)1H123triazole45dicarboxylate
DIETHYL1(2(5(4CHLOROPHENYL)3PHENYL34DIHYDROPYRAZOL2YL)2OXOETHYL)TRIAZOLE45DICARBOXYLATE
InChI=1SC25H24ClN5O5c133524(33)2223(25(34)3642)30(292722)1521(32)3120(178657917)1419(2831)16101218(26)131116h51320H341415H212H3
MFCD03466594
ZINC000000651198
ZINC000000651200
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