Vitas-M small molecule compound

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

Catalog ID
STK889542
SMILES COc1ccc(c(c1)Nc1nc(N)c(c(n1)Nc1ccccc1)[N+](=O)[O-])OC

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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 C18H18N6O4 MW 382.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O4/c1-27-12-8-9-14(28-2)13(10-12)21-18-22-16(19)15(24(25)26)17(23-18)20-11-6-4-3-5-7-11/h3-10H,1-2H3,(H4,19,20,21,22,23)
InChIKey
TZNTWTQEQBUZJG-UHFFFAOYSA-N
Synonyms
673491-40-2
(4AMINO5NITRO6(PHENYLAMINO)PYRIMIDIN2YL)(25DIMETHOXYPHENYL)AMINE
2N(25DIMETHOXYPHENYL)5NITRO4NPHENYLPYRIMIDINE246TRIAMINE
673491402
COC1=CC(=C(C=C1)OC)NC2=NC(=C(C(=N2)NC3=CC=CC=C3)(N+)(=O)(O))N
COc1ccc(c(c1)Nc1nc(N)c(c(n1)Nc1ccccc1)(N+)(=O)(O))OC
InChI=1SC18H18N6O4c127128914(282)13(1012)21182216(19)15(24(25)26)17(2318)20116435711h310H12H3(H41920212223)
MFCD04072719
N~2~(25dimethoxyphenyl)5nitroN~4~phenylpyrimidine246triamine
N2(25DIMETHOXYPHENYL)5NITRON4PHENYLPYRIMIDINE246TRIAMINE
ZINC000009281627
ZINC09281627
ZINC9281627

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Available files

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