Vitas-M small molecule compound
9-(4-ethoxyphenyl)-1-methyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL003314
SMILES CCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccc(cc1)OCC
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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 C22H29N5O3 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O3/c1-4-6-7-13-27-20(28)18-19(24(3)22(27)29)23-21-25(14-8-15-26(18)21)16-9-11-17(12-10-16)30-5-2/h9-12H,4-8,13-15H2,1-3H3InChIKey
IBSWRAWMHMFWJQ-UHFFFAOYSA-NSynonyms
844652-13-7844652137
9(4ETHOXYPHENYL)1METHYL3PENTYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
9(4ethoxyphenyl)1methyl3pentyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
9(4ETHOXYPHENYL)1METHYL3PENTYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
CCCCCN1C(=O)C2=C(N=C3N2CCCN3C4=CC=C(C=C4)OCC)N(C1=O)C
InChI=1SC22H29N5O3c1467132720(28)1819(24(3)22(27)29)232125(1481526(18)21)1691117(121016)3052h912H481315H213H3
MFCD04158585
ZINC000005150433
ZINC05150433
ZINC5150433
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