Vitas-M small molecule compound
7-(4-chlorobenzyl)-1,3-dimethyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL006119
SMILES CC(=C)CSc1nc2c(n1Cc1ccc(cc1)Cl)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 C18H19ClN4O2S MW 390.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN4O2S/c1-11(2)10-26-17-20-15-14(16(24)22(4)18(25)21(15)3)23(17)9-12-5-7-13(19)8-6-12/h5-8H,1,9-10H2,2-4H3InChIKey
VXQIWAGDPJQVEW-UHFFFAOYSA-NSynonyms
476479-92-2476479922
7((4CHLOROPHENYL)METHYL)13DIMETHYL8(2METHYLPROP2ENYLSULFANYL)PURINE26DIONE
7((4CHLOROPHENYL)METHYL)13DIMETHYL8(2METHYLPROP2ENYLTHIO)137TRIHYDROPURINE26DIONE
7(4CHLOROBENZYL)13DIMETHYL8((2METHYLALLYL)THIO)1HPURINE26(3H7H)DIONE
7(4chlorobenzyl)13dimethyl8((2methylprop2en1yl)sulfanyl)37dihydro1Hpurine26dione
CC(=C)CSC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)N(C(=O)N2C)C
InChI=1SC18H19ClN4O2Sc111(2)102617201514(16(24)22(4)18(25)21(15)3)23(17)9125713(19)8612h58H1910H224H3
MFCD03933530
ZINC000000796261
ZINC00796261
ZINC796261
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