Vitas-M small molecule compound
1-(2-chlorobenzyl)-8-{[2-(2,8-dimethyl-1,2,3,4,4a,9b-hexahydro-5H-pyrido[4,3-b]indol-5-yl)-2-oxoethyl]sulfanyl}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK679118
SMILES CN1CCC2C(C1)c1cc(C)ccc1N2C(=O)CSc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1Cl
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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 C29H31ClN6O3S MW 579.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31ClN6O3S/c1-17-9-10-22-19(13-17)20-15-32(2)12-11-23(20)36(22)24(37)16-40-28-31-26-25(33(28)3)27(38)35(29(39)34(26)4)14-18-7-5-6-8-21(18)30/h5-10,13,20,23H,11-12,14-16H2,1-4H3InChIKey
QKSWXWAZXICSEC-UHFFFAOYSA-NSynonyms
1((2CHLOROPHENYL)METHYL)8(2(28DIMETHYL344A9BTETRAHYDRO1HPYRIDO(43B)INDOL5YL)2OXOETHYL)SULFANYL37DIMETHYLPURINE26DIONE
1(2chlorobenzyl)8((2(28dimethyl12344a9bhexahydro5Hpyrido(43b)indol5yl)2oxoethyl)sulfanyl)37dimethyl37dihydro1Hpurine26dione
8(2(28DIMETHYLPIPERIDINO(43B)INDOLIN5YL)2OXOETHYLTHIO)1((2CHLOROPHENYL)METHYL)37DIMETHYL137TRIHYDROPURINE26DIONE
CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=O)CSC4=NC5=C(N4C)C(=O)N(C(=O)N5C)CC6=CC=CC=C6Cl
InChI=1SC29H31ClN6O3Sc1179102219(1317)201532(2)121123(20)36(22)24(37)164028312625(33(28)3)27(38)35(29(39)34(26)4)1418756821(18)30h510132023H11121416H214H3
MFCD03408419
ZINC000000719736
ZINC000059677167
Check stock
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