Vitas-M small molecule compound
ethyl 6-({8-[(2-methoxyethyl)amino]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}methyl)-1-methyl-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK693256
SMILES COCCNc1nc2c(n1CC1=C(C(=O)OCC)C(NC(=O)N1C)c1ccc(cc1)C)c(=O)n(c(=O)n2C)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 C26H33N7O6 MW 539.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N7O6/c1-7-39-23(35)18-17(30(3)25(36)28-19(18)16-10-8-15(2)9-11-16)14-33-20-21(29-24(33)27-12-13-38-6)31(4)26(37)32(5)22(20)34/h8-11,19H,7,12-14H2,1-6H3,(H,27,29)(H,28,36)InChIKey
LRCPOZUEDCUWOW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C)C)CN3C4=C(N=C3NCCOC)N(C(=O)N(C4=O)C)C
ethyl4((8(2methoxyethylamino)13dimethyl26dioxopurin7yl)methyl)3methyl6(4methylphenyl)2oxo16dihydropyrimidine5carboxylate
ethyl6((8((2methoxyethyl)amino)13dimethyl26dioxo1236tetrahydro7Hpurin7yl)methyl)1methyl4(4methylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
InChI=1SC26H33N7O6c173923(35)1817(30(3)25(36)2819(18)1610815(2)91116)14332021(2924(33)271213386)31(4)26(37)32(5)22(20)34h81119H71214H216H3(H2729)(H2836)
MFCD10039359
ZINC000100239398
ZINC000100239402
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