Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-1-(2-chloro-6-fluorobenzyl)-3,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STL011256
SMILES C/C=C/Cn1c(=O)c2n3CC(=NN(c3nc2n(c1=O)C)Cc1c(F)cccc1Cl)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 C20H20ClFN6O2 MW 430.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClFN6O2/c1-4-5-9-26-18(29)16-17(25(3)20(26)30)23-19-27(16)10-12(2)24-28(19)11-13-14(21)7-6-8-15(13)22/h4-8H,9-11H2,1-3H3/b5-4+InChIKey
CMNWPRQQLDAJDT-SNAWJCMRSA-NSynonyms
927576-35-0(E)7(but2en1yl)1(2chloro6fluorobenzyl)39dimethyl79dihydro(124)triazino(34f)purine68(1H4H)dione
7((2E)but2en1yl)1(2chloro6fluorobenzyl)39dimethyl14dihydro(124)triazino(34f)purine68(7H9H)dione
7((2E)BUT2ENYL)1((2CHLORO6FLUOROPHENYL)METHYL)39DIMETHYL579TRIHYDRO4H124TRIAZINO(43H)PURINE68DIONE
7((E)but2enyl)1((2chloro6fluorophenyl)methyl)39dimethyl4Hpurino(87c)(124)triazine68dione
927576350
CC=CCN1C(=O)C2=C(N=C3N2CC(=NN3CC4=C(C=CC=C4Cl)F)C)N(C1=O)C
CC=CCn1c(=O)c2n3CC(=NN(c3nc2n(c1=O)C)Cc1c(F)cccc1Cl)C
InChI=1SC20H20ClFN6O2c14592618(29)1617(25(3)20(26)30)231927(16)1012(2)2428(19)111314(21)76815(13)22h48H911H213H3b54+
MFCD08745025
ZINC000008725394
ZINC08725394
ZINC8725394
Check stock
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