Vitas-M small molecule compound
N~2~-benzyl-N~4~-(2,5-dimethoxyphenyl)-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK569497
SMILES COc1ccc(c(c1)Nc1nc(nc(c1[N+](=O)[O-])N)N(Cc1ccccc1)C)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 C20H22N6O4 MW 410.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O4/c1-25(12-13-7-5-4-6-8-13)20-23-18(21)17(26(27)28)19(24-20)22-15-11-14(29-2)9-10-16(15)30-3/h4-11H,12H2,1-3H3,(H3,21,22,23,24)InChIKey
HLDDAQFNXVUVJA-UHFFFAOYSA-NSynonyms
714245-32-6(4AMINO6((25DIMETHOXYPHENYL)AMINO)5NITROPYRIMIDIN2YL)METHYLBENZYLAMINE
2NBENZYL4N(25DIMETHOXYPHENYL)2NMETHYL5NITROPYRIMIDINE246TRIAMINE
714245326
CN(CC1=CC=CC=C1)C2=NC(=C(C(=N2)NC3=C(C=CC(=C3)OC)OC)(N+)(=O)(O))N
COc1ccc(c(c1)Nc1nc(nc(c1(N+)(=O)(O))N)N(Cc1ccccc1)C)OC
InChI=1SC20H22N6O4c125(12137546813)202318(21)17(26(27)28)19(2420)22151114(292)91016(15)303h411H12H213H3(H321222324)
MFCD05704880
N~2~benzylN~4~(25dimethoxyphenyl)N~2~methyl5nitropyrimidine246triamine
N2BENZYLN4(25DIMETHOXYPHENYL)N2METHYL5NITROPYRIMIDINE246TRIAMINE
ZINC000005253099
ZINC05253099
ZINC5253099
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