Vitas-M small molecule compound
ethyl (2Z)-3-[5-(1H-indol-2-yl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]but-2-enoate
Catalog ID
STL328742
SMILES CCOC(=O)/C=C(\N1N=C(CC1c1cc2c([nH]1)cccc2)c1cccc(c1)[N+](=O)[O-])/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 C23H22N4O4 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4/c1-3-31-23(28)11-15(2)26-22(21-13-17-7-4-5-10-19(17)24-21)14-20(25-26)16-8-6-9-18(12-16)27(29)30/h4-13,22,24H,3,14H2,1-2H3/b15-11-InChIKey
MFPYJSYTPCQIPY-PTNGSMBKSA-NSynonyms
(Z)ethyl3(5(1Hindol2yl)3(3nitrophenyl)45dihydro1Hpyrazol1yl)but2enoate
CCOC(=O)C=C(C)N1C(CC(=N1)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC4=CC=CC=C4N3
CCOC(=O)C=C(N1N=C(CC1c1cc2c((nH)1)cccc2)c1cccc(c1)(N+)(=O)(O))C
ethyl(2Z)3(5(1Hindol2yl)3(3nitrophenyl)45dihydro1Hpyrazol1yl)but2enoate
ethyl(Z)3(3(1Hindol2yl)5(3nitrophenyl)34dihydropyrazol2yl)but2enoate
InChI=1SC23H22N4O4c133123(28)1115(2)2622(2113177451019(17)2421)1420(2526)1686918(1216)27(29)30h4132224H314H212H3b1511
MFCD00325751
ZINC000031829606
ZINC000038597020
Check stock
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