Vitas-M small molecule compound
7-(3,4-diethoxybenzyl)-1,3-dimethyl-8-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK770956
SMILES CCOc1ccc(cc1OCC)Cn1c(SCC(=O)N2CCOCC2)nc2c1c(=O)n(C)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 C24H31N5O6S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N5O6S/c1-5-34-17-8-7-16(13-18(17)35-6-2)14-29-20-21(26(3)24(32)27(4)22(20)31)25-23(29)36-15-19(30)28-9-11-33-12-10-28/h7-8,13H,5-6,9-12,14-15H2,1-4H3InChIKey
KNWYTGWFFMKLTI-UHFFFAOYSA-NSynonyms
7((34DIETHOXYPHENYL)METHYL)13DIMETHYL8(2MORPHOLIN4YL2OXOETHYL)SULFANYLPURINE26DIONE
7(34diethoxybenzyl)13dimethyl8((2(morpholin4yl)2oxoethyl)sulfanyl)37dihydro1Hpurine26dione
CCOC1=C(C=C(C=C1)CN2C3=C(N=C2SCC(=O)N4CCOCC4)N(C(=O)N(C3=O)C)C)OCC
InChI=1SC24H31N5O6Sc1534178716(1318(17)3562)14292021(26(3)24(32)27(4)22(20)31)2523(29)361519(30)2891133121028h7813H569121415H214H3
MFCD03766755
ZINC000000720782
ZINC00720782
ZINC720782
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