Vitas-M small molecule compound
benzyl [9-(3,5-dimethylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Catalog ID
STL003282
SMILES Cc1cc(C)cc(c1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OCc1ccccc1
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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 C27H29N5O4 MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O4/c1-17-10-18(2)12-21(11-17)30-13-19(3)14-31-23-24(28-26(30)31)29(4)27(35)32(25(23)34)15-22(33)36-16-20-8-6-5-7-9-20/h5-12,19H,13-16H2,1-4H3InChIKey
SFOIOKBFPZHAJJ-UHFFFAOYSA-NSynonyms
844854-59-7844854597
benzyl(9(35dimethylphenyl)17dimethyl24dioxo146789hexahydropyrimido(21f)purin3(2H)yl)acetate
benzyl2(9(35dimethylphenyl)17dimethyl24dioxo126789hexahydropyrimido(21f)purin3(4H)yl)acetate
BENZYL2(9(35DIMETHYLPHENYL)17DIMETHYL24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN3YL)ACETATE
CC1CN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CC(=O)OCC4=CC=CC=C4)C5=CC(=CC(=C5)C)C
InChI=1SC27H29N5O4c1171018(2)1221(1117)301319(3)14312324(2826(30)31)29(4)27(35)32(25(23)34)1522(33)3616208657920h51219H1316H214H3
MFCD04164799
PHENYLMETHYL2(9(35DIMETHYLPHENYL)17DIMETHYL24DIOXO135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURIN3YL)ACETATE
ZINC000009109289
ZINC000009109290
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