Vitas-M small molecule compound
3-{2,5-dimethyl-3-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK160407
SMILES CC1=NN(C(=O)/C/1=C/c1cc(n(c1C)c1cccc(c1)C(=O)O)C)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 C24H21N3O3 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O3/c1-15-12-19(17(3)26(15)21-11-7-8-18(13-21)24(29)30)14-22-16(2)25-27(23(22)28)20-9-5-4-6-10-20/h4-14H,1-3H3,(H,29,30)/b22-14+InChIKey
XLSQSVOWGDVYQT-HYARGMPZSA-NSynonyms
3(25DIMETHYL3((E)(3METHYL5OXO1PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
3(25DIMETHYL3((E)(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)METHYL)PYRROL1YL)BENZOICACID
CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)O)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C
CC1=NN(C(=O)C1=Cc1cc(n(c1C)c1cccc(c1)C(=O)O)C)c1ccccc1
InChI=1SC24H21N3O3c1151219(17(3)26(15)21117818(1321)24(29)30)142216(2)2527(23(22)28)2095461020h414H13H3(H2930)b2214+
MFCD04580189
ZINC000004688411
ZINC4688411
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