Vitas-M small molecule compound

N~2~-(4-methylbenzyl)-5-nitro-N~4~-phenylpyrimidine-2,4,6-triamine

Catalog ID
STK557982
SMILES Cc1ccc(cc1)CNc1nc(N)c(c(n1)Nc1ccccc1)[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 C18H18N6O2 MW 350.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O2/c1-12-7-9-13(10-8-12)11-20-18-22-16(19)15(24(25)26)17(23-18)21-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H4,19,20,21,22,23)
InChIKey
CNYRSVAMRIYNAS-UHFFFAOYSA-N
Synonyms
578698-90-5
(6AMINO2(((4METHYLPHENYL)METHYL)AMINO)5NITROPYRIMIDIN4YL)PHENYLAMINE
2N((4METHYLPHENYL)METHYL)5NITRO4NPHENYLPYRIMIDINE246TRIAMINE
578698905
CC1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NC3=CC=CC=C3)(N+)(=O)(O))N
InChI=1SC18H18N6O2c1127913(10812)1120182216(19)15(24(25)26)17(2318)21145324614h210H11H21H3(H41920212223)
MFCD04029139
N~2~(4methylbenzyl)5nitroN~4~phenylpyrimidine246triamine
N2(4METHYLBENZYL)5NITRON4PHENYLPYRIMIDINE246TRIAMINE
ZINC000006400644
ZINC06400644
ZINC6400644

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Available files

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