Vitas-M small molecule compound
6-(4-benzylpiperazin-1-yl)-2-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine
Catalog ID
STL051106
SMILES CC1OC(C)CN(C1)c1nc(N2CCN(CC2)Cc2ccccc2)c(c(n1)N)[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 C21H29N7O3 MW 427.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N7O3/c1-15-12-27(13-16(2)31-15)21-23-19(22)18(28(29)30)20(24-21)26-10-8-25(9-11-26)14-17-6-4-3-5-7-17/h3-7,15-16H,8-14H2,1-2H3,(H2,22,23,24)InChIKey
AXSLYFJCYUFESI-UHFFFAOYSA-NSynonyms
713130-21-36(4benzylpiperazin1yl)2(26dimethylmorpholin4yl)5nitropyrimidin4amine
6(4benzylpiperazin1yl)2(26dimethylmorpholino)5nitropyrimidin4amine
713130213
CC1CN(CC(O1)C)C2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCN(CC3)CC4=CC=CC=C4
CC1OC(C)CN(C1)c1nc(N2CCN(CC2)Cc2ccccc2)c(c(n1)N)(N+)(=O)(O)
InChI=1SC21H29N7O3c1151227(1316(2)3115)212319(22)18(28(29)30)20(2421)2610825(91126)14176435717h371516H814H212H3(H2222324)
MFCD04171561
ZINC000013769701
ZINC000057456731
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