Vitas-M small molecule compound
3-butyl-9-(3,4-dimethylphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL346278
SMILES CCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(c(c1)C)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 C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c1-5-6-10-26-19(27)17-18(23(4)21(26)28)22-20-24(11-7-12-25(17)20)16-9-8-14(2)15(3)13-16/h8-9,13H,5-7,10-12H2,1-4H3InChIKey
XURFDQFRQBSPHR-UHFFFAOYSA-NSynonyms
848866-95-53butyl9(34dimethylphenyl)1methyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
3BUTYL9(34DIMETHYLPHENYL)1METHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
848866955
9(34DIMETHYLPHENYL)3BUTYL1METHYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
CCCCN1C(=O)C2=C(N=C3N2CCCN3C4=CC(=C(C=C4)C)C)N(C1=O)C
InChI=1SC21H27N5O2c156102619(27)1718(23(4)21(26)28)222024(1171225(17)20)169814(2)15(3)1316h8913H571012H214H3
MFCD04197099
ZINC000012374004
ZINC12374004
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