Vitas-M small molecule compound
N~2~-benzyl-N~4~-(4-ethoxyphenyl)-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK558700
SMILES CCOc1ccc(cc1)Nc1nc(nc(c1[N+](=O)[O-])N)N(Cc1ccccc1)C
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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 C20H22N6O3 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O3/c1-3-29-16-11-9-15(10-12-16)22-19-17(26(27)28)18(21)23-20(24-19)25(2)13-14-7-5-4-6-8-14/h4-12H,3,13H2,1-2H3,(H3,21,22,23,24)InChIKey
GMPCNXCHLFUIBZ-UHFFFAOYSA-NSynonyms
587004-55-5(4AMINO6((4ETHOXYPHENYL)AMINO)5NITROPYRIMIDIN2YL)METHYLBENZYLAMINE
2NBENZYL4N(4ETHOXYPHENYL)2NMETHYL5NITROPYRIMIDINE246TRIAMINE
587004555
CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)N(C)CC3=CC=CC=C3
CCOc1ccc(cc1)Nc1nc(nc(c1(N+)(=O)(O))N)N(Cc1ccccc1)C
InChI=1SC20H22N6O3c13291611915(101216)221917(26(27)28)18(21)2320(2419)25(2)13147546814h412H313H212H3(H321222324)
MFCD04034065
N~2~benzylN~4~(4ethoxyphenyl)N~2~methyl5nitropyrimidine246triamine
N2BENZYLN4(4ETHOXYPHENYL)N2METHYL5NITROPYRIMIDINE246TRIAMINE
ZINC000005120288
ZINC05120288
ZINC5120288
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