Vitas-M small molecule compound

9-benzyl-3-(2,4-dichlorobenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione

Catalog ID
STL005996
SMILES Clc1ccc(c(c1)Cl)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)Cc1ccccc1

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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 C23H21Cl2N5O2 MW 470.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21Cl2N5O2/c1-27-20-19(21(31)30(23(27)32)14-16-8-9-17(24)12-18(16)25)29-11-5-10-28(22(29)26-20)13-15-6-3-2-4-7-15/h2-4,6-9,12H,5,10-11,13-14H2,1H3
InChIKey
JNBVKDQVBQWKNC-UHFFFAOYSA-N
Synonyms
850159-80-7
850159807
9BENZYL3((24DICHLOROPHENYL)METHYL)1METHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
9benzyl3(24dichlorobenzyl)1methyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
CN1C2=C(C(=O)N(C1=O)CC3=C(C=C(C=C3)Cl)Cl)N4CCCN(C4=N2)CC5=CC=CC=C5
InChI=1SC23H21Cl2N5O2c1272019(21(31)30(23(27)32)14168917(24)1218(16)25)291151028(22(29)2620)13156324715h246912H510111314H21H3
MFCD05690028
ZINC000009308728
ZINC09308728
ZINC9308728

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Available files

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