Vitas-M small molecule compound
1,3-dimethyl-7-(3-methylbenzyl)-8-{[2-(morpholin-4-yl)ethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK844059
SMILES Cc1cccc(c1)Cn1c(SCCN2CCOCC2)nc2c1c(=O)n(c(=O)n2C)C
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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 C21H27N5O3S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3S/c1-15-5-4-6-16(13-15)14-26-17-18(23(2)21(28)24(3)19(17)27)22-20(26)30-12-9-25-7-10-29-11-8-25/h4-6,13H,7-12,14H2,1-3H3InChIKey
XETCHCFNSHJOOK-UHFFFAOYSA-NSynonyms
672902-37-313DIMETHYL7((3METHYLPHENYL)METHYL)8(2MORPHOLIN4YLETHYLSULFANYL)PURINE26DIONE
13DIMETHYL7((3METHYLPHENYL)METHYL)8(2MORPHOLIN4YLETHYLTHIO)137TRIHYDROPURINE26DIONE
13dimethyl7(3methylbenzyl)8((2(morpholin4yl)ethyl)sulfanyl)37dihydro1Hpurine26dione
13DIMETHYL7(3METHYLBENZYL)8((2MORPHOLINOETHYL)THIO)1HPURINE26(3H7H)DIONE
672902373
CC1=CC(=CC=C1)CN2C3=C(N=C2SCCN4CCOCC4)N(C(=O)N(C3=O)C)C
InChI=1SC21H27N5O3Sc11554616(1315)14261718(23(2)21(28)24(3)19(17)27)2220(26)30129257102911825h4613H71214H213H3
MFCD03417399
ZINC000019973826
ZINC19973826
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