Vitas-M small molecule compound
1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(4-nitrobenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL002468
SMILES CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)[N+](=O)[O-])c(=O)n(c(=O)n2C)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 C19H23N7O4 MW 413.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N7O4/c1-21-8-10-24(11-9-21)18-20-16-15(17(27)23(3)19(28)22(16)2)25(18)12-13-4-6-14(7-5-13)26(29)30/h4-7H,8-12H2,1-3H3InChIKey
SAIFPXDJXFTSIG-UHFFFAOYSA-NSynonyms
953909-15-413dimethyl8(4methylpiperazin1yl)7((4nitrophenyl)methyl)purine26dione
13dimethyl8(4methylpiperazin1yl)7(4nitrobenzyl)1Hpurine26(3H7H)dione
13dimethyl8(4methylpiperazin1yl)7(4nitrobenzyl)37dihydro1Hpurine26dione
953909154
CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)(N+)(=O)(O))c(=O)n(c(=O)n2C)C
CN1CCN(CC1)C2=NC3=C(N2CC4=CC=C(C=C4)(N+)(=O)(O))C(=O)N(C(=O)N3C)C
InChI=1SC19H23N7O4c12181024(11921)18201615(17(27)23(3)19(28)22(16)2)25(18)12134614(7513)26(29)30h47H812H213H3
MFCD04024647
ZINC000009424565
ZINC9424565
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