Vitas-M small molecule compound
N-(4-ethoxyphenyl)-5-[3-hydroxy-5-(4-methylphenyl)-2-oxo-4-phenyl-2,5-dihydro-1H-pyrrol-1-yl]-1H-pyrazole-4-carboxamide
Catalog ID
STL191240
SMILES CCOc1ccc(cc1)NC(=O)c1cn[nH]c1N1C(=O)C(=C(C1c1ccc(cc1)C)c1ccccc1)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 C29H26N4O4 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O4/c1-3-37-22-15-13-21(14-16-22)31-28(35)23-17-30-32-27(23)33-25(20-11-9-18(2)10-12-20)24(26(34)29(33)36)19-7-5-4-6-8-19/h4-17,25,34H,3H2,1-2H3,(H,30,32)(H,31,35)InChIKey
OTBPBNVEORHXOU-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)C2=C(NN=C2)N3C(C(=C(C3=O)O)C4=CC=CC=C4)C5=CC=C(C=C5)C
CCOc1ccc(cc1)NC(=O)c1cn(nH)c1N1C(=O)C(=C(C1c1ccc(cc1)C)c1ccccc1)O
InChI=1SC29H26N4O4c133722151321(141622)3128(35)2317303227(23)3325(2011918(2)101220)24(26(34)29(33)36)197546819h4172534H3H212H3(H3032)(H3135)
MFCD22390262
N(4ethoxyphenyl)5(3hydroxy5(4methylphenyl)2oxo4phenyl25dihydro1Hpyrrol1yl)1Hpyrazole4carboxamide
N(4ethoxyphenyl)5(4hydroxy2(4methylphenyl)5oxo3phenyl2Hpyrrol1yl)1Hpyrazole4carboxamide
ZINC000072332381
ZINC000072332382
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