Vitas-M small molecule compound
1-[(2E)-but-2-en-1-yl]-7-(3,4-dichlorobenzyl)-3,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STK857174
SMILES C/C=C/CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl
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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 C20H20Cl2N6O2 MW 447.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20Cl2N6O2/c1-4-5-8-28-19-23-17-16(26(19)10-12(2)24-28)18(29)27(20(30)25(17)3)11-13-6-7-14(21)15(22)9-13/h4-7,9H,8,10-11H2,1-3H3/b5-4+InChIKey
IBBVZZNTPWVWFQ-SNAWJCMRSA-NSynonyms
929841-10-1(E)1(but2en1yl)7(34dichlorobenzyl)39dimethyl79dihydro(124)triazino(34f)purine68(1H4H)dione
1((2E)but2en1yl)7(34dichlorobenzyl)39dimethyl14dihydro(124)triazino(34f)purine68(7H9H)dione
1((2E)BUT2ENYL)7((34DICHLOROPHENYL)METHYL)39DIMETHYL579TRIHYDRO4H124TRIAZINO(43H)PURINE68DIONE
1((E)but2enyl)7((34dichlorophenyl)methyl)39dimethyl4Hpurino(87c)(124)triazine68dione
929841101
CC=CCN1C2=NC3=C(N2CC(=N1)C)C(=O)N(C(=O)N3C)CC4=CC(=C(C=C4)Cl)Cl
CC=CCN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(c(c1)Cl)Cl
InChI=1SC20H20Cl2N6O2c14582819231716(26(19)1012(2)2428)18(29)27(20(30)25(17)3)11136714(21)15(22)913h479H81011H213H3b54+
MFCD08748839
ZINC000009060398
ZINC09060398
ZINC9060398
Check stock
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Check stock on Vitas-MAvailable files
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