Vitas-M small molecule compound
ethyl 4-{2,5-dimethyl-3-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]-1H-pyrrol-1-yl}benzoate
Catalog ID
STL302386
SMILES CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NN(C1=O)c1ccccc1)C
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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 C26H25N3O3 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3/c1-5-32-26(31)20-11-13-22(14-12-20)28-17(2)15-21(19(28)4)16-24-18(3)27-29(25(24)30)23-9-7-6-8-10-23/h6-16H,5H2,1-4H3/b24-16-InChIKey
OHWWNQZULSLVNS-JLPGSUDCSA-NSynonyms
330633-18-6(E)ethyl4(25dimethyl3((3methyl5oxo1phenyl1Hpyrazol4(5H)ylidene)methyl)1Hpyrrol1yl)benzoate
330633186
CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)C
CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C1C(=NN(C1=O)c1ccccc1)C
ethyl4(25dimethyl3((Z)(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)methyl)1Hpyrrol1yl)benzoate
ETHYL4(25DIMETHYL3((Z)(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)METHYL)PYRROL1YL)BENZOATE
InChI=1SC26H25N3O3c153226(31)20111322(141220)2817(2)1521(19(28)4)162418(3)2729(25(24)30)2397681023h616H5H214H3b2416
MFCD01541360
ZINC000016687899
ZINC16687899
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