Vitas-M small molecule compound
8-{(2E)-2-[(2Z)-2-chloro-3-(4-nitrophenyl)prop-2-en-1-ylidene]hydrazinyl}-7-(2,3-dihydroxypropyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK616322
SMILES OCC(Cn1c(N/N=C/C(=C/c2ccc(cc2)[N+](=O)[O-])/Cl)nc2c1c(O)nc(=O)n2C)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 C18H18ClN7O6 MW 463.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN7O6/c1-24-15-14(16(29)22-18(24)30)25(8-13(28)9-27)17(21-15)23-20-7-11(19)6-10-2-4-12(5-3-10)26(31)32/h2-7,13,27-28H,8-9H2,1H3,(H,21,23)(H,22,29,30)/b11-6-,20-7+InChIKey
UVBNXCPWGFXOJA-LOWAHWRNSA-NSynonyms
115294-97-8115294978
8((2E)2((2Z)2chloro3(4nitrophenyl)prop2en1ylidene)hydrazinyl)7(23dihydroxypropyl)6hydroxy3methyl37dihydro2Hpurin2one
8((2E)2((Z)2chloro3(4nitrophenyl)prop2enylidene)hydrazinyl)7(23dihydroxypropyl)3methylpurine26dione
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC(=CC3=CC=C(C=C3)(N+)(=O)(O))Cl)CC(CO)O
InChI=1SC18H18ClN7O6c1241514(16(29)2218(24)30)25(813(28)927)17(2115)2320711(19)6102412(5310)26(31)32h27132728H89H21H3(H2123)(H222930)b116207+
MFCD08737111
OCC(Cn1c(NN=CC(=Cc2ccc(cc2)(N+)(=O)(O))Cl)nc2c1c(O)nc(=O)n2C)O
ZINC000002317272
ZINC000008744162
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