Vitas-M small molecule compound
N~2~-(butan-2-yl)-N~4~-(4-ethoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STK556581
SMILES CCOc1ccc(cc1)Nc1nc(NC(CC)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/c1-4-10(3)18-16-20-14(17)13(22(23)24)15(21-16)19-11-6-8-12(9-7-11)25-5-2/h6-10H,4-5H2,1-3H3,(H4,17,18,19,20,21)InChIKey
WRFUSJRVQYOTKC-UHFFFAOYSA-NSynonyms
577766-18-82NBUTAN2YL4N(4ETHOXYPHENYL)5NITROPYRIMIDINE246TRIAMINE
577766188
CCC(C)NC1=NC(=C(C(=N1)NC2=CC=C(C=C2)OCC)(N+)(=O)(O))N
CCOc1ccc(cc1)Nc1nc(NC(CC)C)nc(c1(N+)(=O)(O))N
InChI=1SC16H22N6O3c1410(3)18162014(17)13(22(23)24)15(2116)19116812(9711)2552h610H45H213H3(H41718192021)
MFCD04019030
N~2~(butan2yl)N~4~(4ethoxyphenyl)5nitropyrimidine246triamine
N2(BUTAN2YL)N4(4ETHOXYPHENYL)5NITROPYRIMIDINE246TRIAMINE
N2(secbutyl)N4(4ethoxyphenyl)5nitropyrimidine246triamine
ZINC000005030665
ZINC000005030679
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