Vitas-M small molecule compound
(2Z)-3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-1-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-en-1-one
Catalog ID
STL403195
SMILES CCn1nc(c(c1)C(=O)/C=C\c1ccc(o1)c1cc(ccc1Cl)[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 C19H16ClN3O4 MW 385.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O4/c1-3-22-11-16(12(2)21-22)18(24)8-5-14-6-9-19(27-14)15-10-13(23(25)26)4-7-17(15)20/h4-11H,3H2,1-2H3/b8-5-InChIKey
WHRSRQAKKQKULI-YVMONPNESA-NSynonyms
1005637-26-2(2Z)3(5(2chloro5nitrophenyl)furan2yl)1(1ethyl3methyl1Hpyrazol4yl)prop2en1one
(Z)3(5(2chloro5nitrophenyl)furan2yl)1(1ethyl3methylpyrazol4yl)prop2en1one
1005637262
CCN1C=C(C(=N1)C)C(=O)C=CC2=CC=C(O2)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
CCn1nc(c(c1)C(=O)C=Cc1ccc(o1)c1cc(ccc1Cl)(N+)(=O)(O))C
InChI=1SC19H16ClN3O4c13221116(12(2)2122)18(24)85146919(2714)151013(23(25)26)4717(15)20h411H3H212H3b85
MFCD04046203
ZINC000006490240
ZINC06490240
ZINC6490240
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