Vitas-M small molecule compound
7-[(2Z)-3-chlorobut-2-en-1-yl]-8-[(4-chlorobutyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK023340
SMILES ClCCCCSc1nc2c(n1C/C=C(\Cl)/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 C14H18Cl2N4O2S MW 377.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18Cl2N4O2S/c1-9(16)5-7-20-10-11(19(2)13(22)18-12(10)21)17-14(20)23-8-4-3-6-15/h5H,3-4,6-8H2,1-2H3,(H,18,21,22)/b9-5-InChIKey
NITDKHANLGZLFL-UITAMQMPSA-NSynonyms
1404306-95-1(Z)7(3chlorobut2en1yl)8((4chlorobutyl)thio)3methyl1Hpurine26(3H7H)dione
1404306951
7((2Z)3CHLOROBUT2EN1YL)8((4CHLOROBUTYL)SULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
7((2Z)3CHLOROBUT2ENYL)8(4CHLOROBUTYLTHIO)3METHYL137TRIHYDROPURINE26DIONE
7((Z)3CHLOROBUT2ENYL)8(4CHLOROBUTYLSULFANYL)3METHYLPURINE26DIONE
7(3CHLORO2BUTENYL)8((4CHLOROBUTYL)SULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
CC(=CCN1C2=C(N=C1SCCCCCl)N(C(=O)NC2=O)C)Cl
ClCCCCSc1nc2c(n1CC=C(Cl)C)c(=O)(nH)c(=O)n2C
InChI=1SC14H18Cl2N4O2Sc19(16)57201011(19(2)13(22)1812(10)21)1714(20)23843615h5H3468H212H3(H182122)b95
MFCD01032053
STK023340
ZINC000013577212
ZINC13577212
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