Vitas-M small molecule compound
N~4~-(4-methoxyphenyl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STL345912
SMILES COc1ccc(cc1)Nc1nc(NCCC(C)C)nc(c1[N+](=O)[O-])N
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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 C16H22N6O3 MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N6O3/c1-10(2)8-9-18-16-20-14(17)13(22(23)24)15(21-16)19-11-4-6-12(25-3)7-5-11/h4-7,10H,8-9H2,1-3H3,(H4,17,18,19,20,21)InChIKey
BIVDZOLEQKYTEW-UHFFFAOYSA-NSynonyms
672319-57-24N(4METHOXYPHENYL)2N(3METHYLBUTYL)5NITROPYRIMIDINE246TRIAMINE
672319572
CC(C)CCNC1=NC(=C(C(=N1)NC2=CC=C(C=C2)OC)(N+)(=O)(O))N
COc1ccc(cc1)Nc1nc(NCCC(C)C)nc(c1(N+)(=O)(O))N
InChI=1SC16H22N6O3c110(2)8918162014(17)13(22(23)24)15(2116)19114612(253)7511h4710H89H213H3(H41718192021)
MFCD04073842
N~4~(4methoxyphenyl)N~2~(3methylbutyl)5nitropyrimidine246triamine
N2isopentylN4(4methoxyphenyl)5nitropyrimidine246triamine
N4(4METHOXYPHENYL)N2(3METHYLBUTYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000005249636
ZINC05249636
ZINC5249636
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