Vitas-M small molecule compound
3-butyl-1,7-dimethyl-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL002020
SMILES CCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)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/c1-5-6-11-24-19(27)17-18(23(4)21(24)28)22-20-25(12-15(3)13-26(17)20)16-9-7-14(2)8-10-16/h7-10,15H,5-6,11-13H2,1-4H3InChIKey
IVBBKTOHLMJIKS-UHFFFAOYSA-NSynonyms
845989-09-53BUTYL17DIMETHYL9(4METHYLPHENYL)135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3butyl17dimethyl9(4methylphenyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
3BUTYL17DIMETHYL9(4METHYLPHENYL)78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3butyl17dimethyl9(ptolyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
845989095
CCCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=C(C=C4)C)C)N(C1=O)C
InChI=1SC21H27N5O2c156112419(27)1718(23(4)21(24)28)222025(1215(3)1326(17)20)169714(2)81016h71015H561113H214H3
MFCD04171643
ZINC000008628272
ZINC000008628273
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