Vitas-M small molecule compound
7-[(2Z)-3-chlorobut-2-en-1-yl]-8-(hexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK539056
SMILES CCCCCCNc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C
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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 C16H24ClN5O2 MW 353.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24ClN5O2/c1-4-5-6-7-9-18-15-19-13-12(22(15)10-8-11(2)17)14(23)20-16(24)21(13)3/h8H,4-7,9-10H2,1-3H3,(H,18,19)(H,20,23,24)/b11-8-InChIKey
GGNZRKOFWFXNGF-FLIBITNWSA-NSynonyms
305866-23-3(Z)7(3chlorobut2en1yl)8(hexylamino)3methyl1Hpurine26(3H7H)dione
305866233
7((2Z)3chlorobut2en1yl)8(hexylamino)3methyl37dihydro1Hpurine26dione
7((Z)3CHLOROBUT2ENYL)8(HEXYLAMINO)3METHYLPURINE26DIONE
CCCCCCNC1=NC2=C(N1CC=C(C)Cl)C(=O)NC(=O)N2C
CCCCCCNc1nc2c(n1CC=C(Cl)C)c(=O)(nH)c(=O)n2C
InChI=1SC16H24ClN5O2c1456791815191312(22(15)10811(2)17)14(23)2016(24)21(13)3h8H47910H213H3(H1819)(H202324)b118
MFCD01553920
ZINC000013512240
ZINC13512240
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