Vitas-M small molecule compound
(4Z)-5-hydroxy-4-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL406006
SMILES OC1=NN(C(=O)/C/1=C\c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])C)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 C21H15N3O5 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5/c1-13-7-8-14(11-18(13)24(27)28)19-10-9-16(29-19)12-17-20(25)22-23(21(17)26)15-5-3-2-4-6-15/h2-12H,1H3,(H,22,25)/b17-12-InChIKey
NXJQNKIWOBBRPO-ATVHPVEESA-NSynonyms
(4Z)5hydroxy4((5(4methyl3nitrophenyl)furan2yl)methylidene)2phenyl24dihydro3Hpyrazol3one
CC1=C(C=C(C=C1)C2=CC=C(O2)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC21H15N3O5c1137814(1118(13)24(27)28)1910916(2919)121720(25)2223(21(17)26)155324615h212H1H3(H2225)b1712
MFCD30704397
OC1=NN(C(=O)C1=Cc1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))C)c1ccccc1
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