Vitas-M small molecule compound

(1-ethyl-4-nitro-1H-pyrazol-3-yl)[5-(2-hydroxyphenyl)-3-(naphthalen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]methanone

Catalog ID
STL404052
SMILES CCn1cc(c(n1)C(=O)N1N=C(CC1c1ccccc1O)c1ccc2c(c1)cccc2)[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 C25H21N5O4 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4/c1-2-28-15-22(30(33)34)24(27-28)25(32)29-21(19-9-5-6-10-23(19)31)14-20(26-29)18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,21,31H,2,14H2,1H3
InChIKey
XFWCDZQGWJPSIY-UHFFFAOYSA-N
Synonyms
512816-06-7
(1ethyl4nitro1Hpyrazol3yl)(5(2hydroxyphenyl)3(naphthalen2yl)45dihydro1Hpyrazol1yl)methanone
(1ETHYL4NITROPYRAZOL3YL)(3(2HYDROXYPHENYL)5NAPHTHALEN2YL34DIHYDROPYRAZOL2YL)METHANONE
2(1((1ETHYL4NITRO1HPYRAZOL3YL)CARBONYL)3(2NAPHTHYL)45DIHYDRO1HPYRAZOL5YL)PHENOL
512816067
CCN1C=C(C(=N1)C(=O)N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5O)(N+)(=O)(O)
CCn1cc(c(n1)C(=O)N1N=C(CC1c1ccccc1O)c1ccc2c(c1)cccc2)(N+)(=O)(O)
InChI=1SC25H21N5O4c12281522(30(33)34)24(2728)25(32)2921(199561023(19)31)1420(2629)18121116734817(16)1318h313152131H214H21H3
MFCD03467337
ZINC000000655357
ZINC000000655359

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Available files

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