Vitas-M small molecule compound
[3-(4-chlorophenyl)-5-(2-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
Catalog ID
STL402277
SMILES CCn1cc(c(n1)C(=O)N1N=C(CC1c1ccccc1O)c1ccc(cc1)Cl)[N+](=O)[O-]
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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 C21H18ClN5O4 MW 439.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O4/c1-2-25-12-18(27(30)31)20(24-25)21(29)26-17(15-5-3-4-6-19(15)28)11-16(23-26)13-7-9-14(22)10-8-13/h3-10,12,17,28H,2,11H2,1H3InChIKey
JXQSFMVBCMBABC-UHFFFAOYSA-NSynonyms
512817-18-4(3(4chlorophenyl)5(2hydroxyphenyl)45dihydro1Hpyrazol1yl)(1ethyl4nitro1Hpyrazol3yl)methanone
(5(4CHLOROPHENYL)3(2HYDROXYPHENYL)34DIHYDROPYRAZOL2YL)(1ETHYL4NITROPYRAZOL3YL)METHANONE
512817184
CCN1C=C(C(=N1)C(=O)N2C(CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4O)(N+)(=O)(O)
CCn1cc(c(n1)C(=O)N1N=C(CC1c1ccccc1O)c1ccc(cc1)Cl)(N+)(=O)(O)
InChI=1SC21H18ClN5O4c12251218(27(30)31)20(2425)21(29)2617(15534619(15)28)1116(2326)137914(22)10813h310121728H211H21H3
MFCD03467944
ZINC000000653975
ZINC000000653976
Check stock
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