Vitas-M small molecule compound
7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-8-(pentylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK091310
SMILES CCCCCSc1nc2c(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 C15H21ClN4O2S MW 356.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21ClN4O2S/c1-4-5-6-9-23-15-17-12-11(20(15)8-7-10(2)16)13(21)18-14(22)19(12)3/h7H,4-6,8-9H2,1-3H3,(H,18,21,22)/b10-7-InChIKey
BQBSUBNFFSVLLC-YFHOEESVSA-NSynonyms
331726-06-8(Z)7(3chlorobut2en1yl)3methyl8(pentylthio)1Hpurine26(3H7H)dione
331726068
7((2Z)3CHLOROBUT2EN1YL)3METHYL8(PENTYLSULFANYL)37DIHYDRO1HPURINE26DIONE
7((2Z)3CHLOROBUT2ENYL)3METHYL8PENTYLTHIO137TRIHYDROPURINE26DIONE
7((Z)3CHLOROBUT2ENYL)3METHYL8PENTYLSULFANYLPURINE26DIONE
7(3CHLOROBUT2ENYL)3METHYL8PENTYLSULFANYL37DIHYDROPURINE26DIONE
CCCCCSC1=NC2=C(N1CC=C(C)Cl)C(=O)NC(=O)N2C
CCCCCSc1nc2c(n1CC=C(Cl)C)c(=O)(nH)c(=O)n2C
InChI=1SC15H21ClN4O2Sc145692315171211(20(15)8710(2)16)13(21)1814(22)19(12)3h7H4689H213H3(H182122)b107
MFCD01079278
STK091310
ZINC000013575052
ZINC13575052
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