Vitas-M small molecule compound
N~2~-[2-(4-methoxyphenyl)-2-(morpholin-4-yl)ethyl]-N~4~-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
Catalog ID
STL411695
SMILES COc1ccc(cc1)C(N1CCOCC1)CNc1nc(N)c(c(n1)Nc1ccc(cc1)C)[N+](=O)[O-]
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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 C24H29N7O4 MW 479.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N7O4/c1-16-3-7-18(8-4-16)27-23-21(31(32)33)22(25)28-24(29-23)26-15-20(30-11-13-35-14-12-30)17-5-9-19(34-2)10-6-17/h3-10,20H,11-15H2,1-2H3,(H4,25,26,27,28,29)InChIKey
NENDYPHQNSSFIA-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)NC2=NC(=NC(=C2(N+)(=O)(O))N)NCC(C3=CC=C(C=C3)OC)N4CCOCC4
COc1ccc(cc1)C(N1CCOCC1)CNc1nc(N)c(c(n1)Nc1ccc(cc1)C)(N+)(=O)(O)
InChI=1SC24H29N7O4c1163718(8416)272321(31(32)33)22(25)2824(2923)261520(30111335141230)175919(342)10617h31020H1115H212H3(H42526272829)
MFCD28577920
N~2~(2(4methoxyphenyl)2(morpholin4yl)ethyl)N~4~(4methylphenyl)5nitropyrimidine246triamine
N2(2(4METHOXYPHENYL)2(MORPHOLIN4YL)ETHYL)N4(4METHYLPHENYL)5NITROPYRIMIDINE246TRIAMINE
ZINC000170621885
ZINC000170621886
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