Vitas-M small molecule compound
6-(4-benzylpiperidin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
Catalog ID
STK556987
SMILES CC(CCNc1nc(N2CCC(CC2)Cc2ccccc2)c(c(n1)N)[N+](=O)[O-])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 C21H30N6O2 MW 398.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N6O2/c1-15(2)8-11-23-21-24-19(22)18(27(28)29)20(25-21)26-12-9-17(10-13-26)14-16-6-4-3-5-7-16/h3-7,15,17H,8-14H2,1-2H3,(H3,22,23,24,25)InChIKey
PKEPFOQQMANNDP-UHFFFAOYSA-NSynonyms
577983-26-7(4AMINO5NITRO6(4BENZYLPIPERIDYL)PYRIMIDIN2YL)(3METHYLBUTYL)AMINE
577983267
6(4BENZYLPIPERIDIN1YL)2N(3METHYLBUTYL)5NITROPYRIMIDINE24DIAMINE
6(4benzylpiperidin1yl)N~2~(3methylbutyl)5nitropyrimidine24diamine
6(4BENZYLPIPERIDIN1YL)N2(3METHYLBUTYL)5NITROPYRIMIDINE24DIAMINE
6(4benzylpiperidin1yl)N2isopentyl5nitropyrimidine24diamine
CC(C)CCNC1=NC(=C(C(=N1)N)(N+)(=O)(O))N2CCC(CC2)CC3=CC=CC=C3
CC(CCNc1nc(N2CCC(CC2)Cc2ccccc2)c(c(n1)N)(N+)(=O)(O))C
InChI=1SC21H30N6O2c115(2)81123212419(22)18(27(28)29)20(2521)2612917(101326)14166435716h371517H814H212H3(H322232425)
MFCD03491717
ZINC000005031940
ZINC05031940
ZINC5031940
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