Vitas-M small molecule compound
butyl 2-chloro-5-{5-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STL431844
SMILES CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)/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 C26H23ClN2O4 MW 462.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4/c1-3-4-14-32-26(31)22-15-18(10-12-23(22)27)24-13-11-20(33-24)16-21-17(2)28-29(25(21)30)19-8-6-5-7-9-19/h5-13,15-16H,3-4,14H2,1-2H3/b21-16-InChIKey
DEUIXJQTNNMKTP-PGMHBOJBSA-NSynonyms
(Z)BUTYL2CHLORO5(5((3METHYL5OXO1PHENYL1HPYRAZOL4(5H)YLIDENE)METHYL)FURAN2YL)BENZOATE
BUTYL2CHLORO5(5((3METHYL5OXO1PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)2FURYL)BENZOATE
butyl2chloro5(5((Z)(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)methyl)furan2yl)benzoate
BUTYL2CHLORO5(5((Z)(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)METHYL)FURAN2YL)BENZOATE
CCCCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)Cl
CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC26H23ClN2O4c134143226(31)221518(101223(22)27)24131120(3324)162117(2)2829(25(21)30)198657919h5131516H3414H212H3b2116
MFCD01158718
ZINC000013602628
ZINC13602628
Check stock
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Check stock on Vitas-MAvailable files
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