Vitas-M small molecule compound

5-methyl-4-[(4-nitrophenyl)carbonyl]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK246920
SMILES CC1=NN(C(=O)C1C(=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1

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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 C17H13N3O4 MW 323.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O4/c1-11-15(16(21)12-7-9-14(10-8-12)20(23)24)17(22)19(18-11)13-5-3-2-4-6-13/h2-10,15H,1H3
InChIKey
QHRMOZIIQNCORN-UHFFFAOYSA-N
Synonyms
66755-21-3
3HPYRAZOL3ONE24DIHYDRO5METHYL4(4NITROBENZOYL)2PHENYL
5METHYL4((4NITROPHENYL)CARBONYL)2PHENYL24DIHYDRO3HPYRAZOL3ONE
5METHYL4(4NITROBENZOYL)2PHENYL24DIHYDRO3HPYRAZOL3ONE
5METHYL4(4NITROBENZOYL)2PHENYL4HPYRAZOL3ONE
66755213
CC1=NN(C(=O)C1C(=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
CC1=NN(C(=O)C1C(=O)C2=CC=C(C=C2)(N+)(=O)(O))C3=CC=CC=C3
InChI=1SC17H13N3O4c11115(16(21)127914(10812)20(23)24)17(22)19(1811)135324613h21015H1H3
MFCD00561089
ZINC000018240404
ZINC000100507434

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Available files

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