Vitas-M small molecule compound
4-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]-2-methoxyphenyl 2,4-dichlorobenzoate
Catalog ID
STK003210
SMILES COc1cc(ccc1OC(=O)c1ccc(cc1Cl)Cl)C(c1c(O)[nH]nc1C)c1c(O)[nH]nc1C
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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 C23H20Cl2N4O5 MW 503.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20Cl2N4O5/c1-10-18(21(30)28-26-10)20(19-11(2)27-29-22(19)31)12-4-7-16(17(8-12)33-3)34-23(32)14-6-5-13(24)9-15(14)25/h4-9,20H,1-3H3,(H2,26,28,30)(H2,27,29,31)InChIKey
GSWXUYIYHPVPJJ-UHFFFAOYSA-NSynonyms
879439-90-4(4(BIS(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)2METHOXYPHENYL)24DICHLOROBENZOATE
4(BIS(5HYDROXY3METHYL1HPYRAZOL4YL)METHYL)2METHOXYPHENYL24DICHLOROBENZOATE
879439904
CC1=C(C(=O)NN1)C(C2=CC(=C(C=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl)OC)C4=C(NNC4=O)C
COc1cc(ccc1OC(=O)c1ccc(cc1Cl)Cl)C(c1c(O)(nH)nc1C)c1c(O)(nH)nc1C
InChI=1SC23H20Cl2N4O5c11018(21(30)282610)20(1911(2)272922(19)31)124716(17(812)333)3423(32)146513(24)915(14)25h4920H13H3(H2262830)(H2272931)
MFCD03269245
STK003210
ZINC000019799832
ZINC19799832
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