Vitas-M small molecule compound
ethyl 5-{[({[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]methyl}furan-2-carboxylate
Catalog ID
STK685654
SMILES CCOC(=O)c1ccc(o1)CNC(=O)CSc1nc2c(n1Cc1ccccc1Cl)c(=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 C24H24ClN5O6S MW 546.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN5O6S/c1-4-35-22(33)17-10-9-15(36-17)11-26-18(31)13-37-23-27-20-19(21(32)29(3)24(34)28(20)2)30(23)12-14-7-5-6-8-16(14)25/h5-10H,4,11-13H2,1-3H3,(H,26,31)InChIKey
GPHZSDGBLLAPBH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(O1)CNC(=O)CSC2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)N(C(=O)N3C)C
ethyl5(((((7(2chlorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetyl)amino)methyl)furan2carboxylate
ETHYL5(((2(7((2CHLOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)SULFANYLACETYL)AMINO)METHYL)FURAN2CARBOXYLATE
InChI=1SC24H24ClN5O6Sc143522(33)1710915(3617)112618(31)133723272019(21(32)29(3)24(34)28(20)2)30(23)1214756816(14)25h510H41113H213H3(H2631)
MFCD05860015
ZINC000098007374
ZINC98007374
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