Vitas-M small molecule compound

8-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK833936
SMILES Clc1ccc(cc1)C(=O)CSc1nc2c(n1C)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 C15H13ClN4O3S MW 364.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN4O3S/c1-19-11-12(20(2)14(23)18-13(11)22)17-15(19)24-7-10(21)8-3-5-9(16)6-4-8/h3-6H,7H2,1-2H3,(H,18,22,23)
InChIKey
LAYLZGGSMJKXBZ-UHFFFAOYSA-N
Synonyms
299421-61-7
299421617
8((2(4chlorophenyl)2oxoethyl)sulfanyl)37dimethyl37dihydro1Hpurine26dione
8((2(4CHLOROPHENYL)2OXOETHYL)THIO)37DIMETHYL1HPURINE26(3H7H)DIONE
8(2(4chlorophenyl)2oxoethyl)sulfanyl37dimethylpurine26dione
8(2(4CHLOROPHENYL)2OXOETHYLTHIO)37DIMETHYL137TRIHYDROPURINE26DIONE
Clc1ccc(cc1)C(=O)CSc1nc2c(n1C)c(=O)(nH)c(=O)n2C
CN1C2=C(N=C1SCC(=O)C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C
InChI=1SC15H13ClN4O3Sc1191112(20(2)14(23)1813(11)22)1715(19)24710(21)8359(16)648h36H7H212H3(H182223)
MFCD00230458
ZINC000000894400
ZINC00894400
ZINC894400

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Available files

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