Vitas-M small molecule compound
7-[(2E)-3-chlorobut-2-en-1-yl]-8-{[2-(diethylamino)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL005729
SMILES CCN(CCNc1nc2c(n1C/C=C(/Cl)\C)c(=O)n(c(=O)n2C)C)CC
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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 C17H27ClN6O2 MW 382.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H27ClN6O2/c1-6-23(7-2)11-9-19-16-20-14-13(24(16)10-8-12(3)18)15(25)22(5)17(26)21(14)4/h8H,6-7,9-11H2,1-5H3,(H,19,20)/b12-8+InChIKey
IBGMVIHZTMPJMI-XYOKQWHBSA-NSynonyms
478252-89-0(E)7(3chlorobut2en1yl)8((2(diethylamino)ethyl)amino)13dimethyl1Hpurine26(3H7H)dione
478252890
7((2E)3chlorobut2en1yl)8((2(diethylamino)ethyl)amino)13dimethyl37dihydro1Hpurine26dione
7((E)3chlorobut2enyl)8(2(diethylamino)ethylamino)13dimethylpurine26dione
7((E)3CHLOROBUT2ENYL)8(2DIETHYLAMINOETHYLAMINO)13DIMETHYLPURINE26DIONE
7(3CHLOROBUT2EN1YL)8((2(DIETHYLAMINO)ETHYL)AMINO)13DIMETHYL1HPURINE26(3H7H)DIONE
CCN(CC)CCNC1=NC2=C(N1CC=C(C)Cl)C(=O)N(C(=O)N2C)C
CCN(CCNc1nc2c(n1CC=C(Cl)C)c(=O)n(c(=O)n2C)C)CC
InChI=1SC17H27ClN6O2c1623(72)1191916201413(24(16)10812(3)18)15(25)22(5)17(26)21(14)4h8H67911H215H3(H1920)b128+
MFCD03933674
ZINC000000801661
ZINC801661
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