Vitas-M small molecule compound

N~4~-benzyl-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine

Catalog ID
STK556593
SMILES CNc1nc(NCc2ccccc2)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 C12H14N6O2 MW 274.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N6O2/c1-14-12-16-10(13)9(18(19)20)11(17-12)15-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H4,13,14,15,16,17)
InChIKey
RHILCTGZYTXVQH-UHFFFAOYSA-N
Synonyms
577767-58-9
(6AMINO2(METHYLAMINO)5NITROPYRIMIDIN4YL)BENZYLAMINE
4NBENZYL2NMETHYL5NITROPYRIMIDINE246TRIAMINE
577767589
CNC1=NC(=C(C(=N1)NCC2=CC=CC=C2)(N+)(=O)(O))N
CNc1nc(NCc2ccccc2)c(c(n1)N)(N+)(=O)(O)
InChI=1SC12H14N6O2c114121610(13)9(18(19)20)11(1712)1578532468h26H7H21H3(H41314151617)
MFCD03491755
N~4~benzylN~2~methyl5nitropyrimidine246triamine
N4BENZYLN2METHYL5NITROPYRIMIDINE246TRIAMINE
NBENZYLNMETHYL5NITROPYRIMIDINE246TRIAMINE
ZINC000005030717
ZINC05030717
ZINC5030717

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Available files

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