Vitas-M small molecule compound

methyl 4-methyl-3-{[(4-nitro-1H-pyrazol-1-yl)acetyl]amino}benzoate

Catalog ID
STK316878
SMILES COC(=O)c1ccc(c(c1)NC(=O)Cn1ncc(c1)[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 C14H14N4O5 MW 318.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O5/c1-9-3-4-10(14(20)23-2)5-12(9)16-13(19)8-17-7-11(6-15-17)18(21)22/h3-7H,8H2,1-2H3,(H,16,19)
InChIKey
ZVFYZXXQEOSMHU-UHFFFAOYSA-N
Synonyms
515151-05-0
515151050
CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C=C(C=N2)(N+)(=O)(O)
COC(=O)c1ccc(c(c1)NC(=O)Cn1ncc(c1)(N+)(=O)(O))C
InChI=1SC14H14N4O5c193410(14(20)232)512(9)1613(19)817711(61517)18(21)22h37H8H212H3(H1619)
METHYL3(((4NITRO1HPYRAZOL1YL)ACETYL)AMINO)4METHYLBENZOATE
methyl4methyl3(((4nitro1Hpyrazol1yl)acetyl)amino)benzoate
METHYL4METHYL3((2(4NITROPYRAZOL1YL)ACETYL)AMINO)BENZOATE
MFCD03072459
ZINC000002763700
ZINC02763700
ZINC2763700

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Available files

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