Vitas-M small molecule compound
benzyl [9-(4-chlorophenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Catalog ID
STL006947
SMILES CC1CN(c2ccc(cc2)Cl)c2n(C1)c1c(=O)n(CC(=O)OCc3ccccc3)c(=O)n(c1n2)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 C25H24ClN5O4 MW 493.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN5O4/c1-16-12-29(19-10-8-18(26)9-11-19)24-27-22-21(30(24)13-16)23(33)31(25(34)28(22)2)14-20(32)35-15-17-6-4-3-5-7-17/h3-11,16H,12-15H2,1-2H3InChIKey
HDQFQLAMFINAJS-UHFFFAOYSA-NSynonyms
850803-08-6850803086
benzyl(9(4chlorophenyl)17dimethyl24dioxo146789hexahydropyrimido(21f)purin3(2H)yl)acetate
benzyl2(9(4chlorophenyl)17dimethyl24dioxo126789hexahydropyrimido(21f)purin3(4H)yl)acetate
BENZYL2(9(4CHLOROPHENYL)17DIMETHYL24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN3YL)ACETATE
CC1CN(C2=NC3=C(N2C1)C(=O)N(C(=O)N3C)CC(=O)OCC4=CC=CC=C4)C5=CC=C(C=C5)Cl
InChI=1SC25H24ClN5O4c1161229(1910818(26)91119)24272221(30(24)1316)23(33)31(25(34)28(22)2)1420(32)3515176435717h31116H1215H212H3
MFCD05695691
ZINC000009291616
ZINC000009291617
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