Vitas-M small molecule compound

N-{4-amino-6-[(3,4-dimethylphenyl)amino]-5-nitropyrimidin-2-yl}glycine

Catalog ID
STK557878
SMILES OC(=O)CNc1nc(Nc2ccc(c(c2)C)C)c(c(n1)N)[N+](=O)[O-]

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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 C14H16N6O4 MW 332.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N6O4/c1-7-3-4-9(5-8(7)2)17-13-11(20(23)24)12(15)18-14(19-13)16-6-10(21)22/h3-5H,6H2,1-2H3,(H,21,22)(H4,15,16,17,18,19)
InChIKey
YYSVFPALDQAOGI-UHFFFAOYSA-N
Synonyms
585559-11-1
2((4AMINO6((34DIMETHYLPHENYL)AMINO)5NITROPYRIMIDIN2YL)AMINO)ACETICACID
2((4AMINO6(34DIMETHYLANILINO)5NITROPYRIMIDIN2YL)AMINO)ACETICACID
585559111
CC1=C(C=C(C=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)NCC(=O)O)C
InChI=1SC14H16N6O4c17349(58(7)2)171311(20(23)24)12(15)1814(1913)16610(21)22h35H6H212H3(H2122)(H41516171819)
MFCD04028376
N(4amino6((34dimethylphenyl)amino)5nitropyrimidin2yl)glycine
OC(=O)CNc1nc(Nc2ccc(c(c2)C)C)c(c(n1)N)(N+)(=O)(O)
ZINC000004306080
ZINC4306080

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Available files

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