Vitas-M small molecule compound
4-[7-(4-chlorophenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-9-ium-8-yl]phenolate
Catalog ID
STK568004
SMILES [O-]c1ccc(cc1)n1c(cn2c1[nH+]c1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)Cl
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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 C21H16ClN5O3 MW 421.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN5O3/c1-24-18-17(19(29)25(2)21(24)30)26-11-16(12-3-5-13(22)6-4-12)27(20(26)23-18)14-7-9-15(28)10-8-14/h3-11,28H,1-2H3InChIKey
MFVWSTIYXDSQNF-UHFFFAOYSA-NSynonyms
847185-42-6(O)c1ccc(cc1)n1c(cn2c1(nH+)c1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)Cl
4(7(4chlorophenyl)13dimethyl24dioxo1234tetrahydro8Himidazo(21f)purin9ium8yl)phenolate
7(4CHLOROPHENYL)6(4HYDROXYPHENYL)24DIMETHYLPURINO(78A)IMIDAZOLE13DIONE
847185426
CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)Cl
InChI=1SC21H16ClN5O3c1241817(19(29)25(2)21(24)30)261116(123513(22)6412)27(20(26)2318)147915(28)10814h31128H12H3
MFCD04184909
ZINC000009160334
ZINC09160334
ZINC9160334
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