Vitas-M small molecule compound
8-[(4-chlorobenzyl)sulfanyl]-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK833830
SMILES Clc1ccc(cc1)CSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]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 C21H19ClN4O2S MW 426.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O2S/c1-13-4-3-5-15(10-13)11-26-17-18(25(2)20(28)24-19(17)27)23-21(26)29-12-14-6-8-16(22)9-7-14/h3-10H,11-12H2,1-2H3,(H,24,27,28)InChIKey
JXKBKZWTQVGIAK-UHFFFAOYSA-NSynonyms
303973-17-3303973173
8((4chlorobenzyl)sulfanyl)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8((4chlorobenzyl)thio)3methyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8((4CHLOROPHENYL)METHYLSULFANYL)3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8((4CHLOROPHENYL)METHYLTHIO)3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2SCC4=CC=C(C=C4)Cl)N(C(=O)NC3=O)C
Clc1ccc(cc1)CSc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
InChI=1SC21H19ClN4O2Sc11343515(1013)11261718(25(2)20(28)2419(17)27)2321(26)2912146816(22)9714h310H1112H212H3(H242728)
MFCD01186399
ZINC000000839501
ZINC00839501
ZINC839501
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