Vitas-M small molecule compound

methyl 4-[1,3-dimethyl-7-(naphthalen-2-yl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate

Catalog ID
STK979226
SMILES COC(=O)c1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc2c(c1)cccc2

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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 C27H21N5O4 MW 479.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N5O4/c1-29-23-22(24(33)30(2)27(29)35)31-15-21(19-9-8-16-6-4-5-7-18(16)14-19)32(26(31)28-23)20-12-10-17(11-13-20)25(34)36-3/h4-15H,1-3H3
InChIKey
GUXQTSJSLZURJT-UHFFFAOYSA-N
Synonyms
861139-18-6
861139186
CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)C4=CC=C(C=C4)C(=O)OC)C5=CC6=CC=CC=C6C=C5
InChI=1SC27H21N5O4c1292322(24(33)30(2)27(29)35)311521(199816645718(16)1419)32(26(31)2823)20121017(111320)25(34)363h415H13H3
methyl4(13dimethyl7(naphthalen2yl)24dioxo1234tetrahydro8Himidazo(21f)purin8yl)benzoate
methyl4(13dimethyl7(naphthalen2yl)24dioxo34dihydro1Himidazo(21f)purin8(2H)yl)benzoate
METHYL4(24DIMETHYL7NAPHTHALEN2YL13DIOXOPURINO(78A)IMIDAZOL6YL)BENZOATE
MFCD05683763
ZINC000009307957
ZINC09307957
ZINC9307957

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Available files

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