Vitas-M small molecule compound
4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(4-methoxy-2-nitrophenyl)-5-methyl-1,2-oxazole-3-carboxamide
Catalog ID
STL400332
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1noc(c1Cn1nc(c(c1C)[N+](=O)[O-])C)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 C18H18N6O7 MW 430.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O7/c1-9-17(24(28)29)10(2)22(20-9)8-13-11(3)31-21-16(13)18(25)19-14-6-5-12(30-4)7-15(14)23(26)27/h5-7H,8H2,1-4H3,(H,19,25)InChIKey
QZYGJPXFUUIJFW-UHFFFAOYSA-NSynonyms
1006996-57-11006996571
4((35dimethyl4nitro1Hpyrazol1yl)methyl)N(4methoxy2nitrophenyl)5methyl12oxazole3carboxamide
4((35dimethyl4nitropyrazol1yl)methyl)N(4methoxy2nitrophenyl)5methyl12oxazole3carboxamide
CC1=C(C(=NN1CC2=C(ON=C2C(=O)NC3=C(C=C(C=C3)OC)(N+)(=O)(O))C)C)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)c1noc(c1Cn1nc(c(c1C)(N+)(=O)(O))C)C
InChI=1SC18H18N6O7c1917(24(28)29)10(2)22(209)81311(3)312116(13)18(25)19146512(304)715(14)23(26)27h57H8H214H3(H1925)
MFCD08554333
ZINC000017096802
ZINC17096802
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