Vitas-M small molecule compound
(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Catalog ID
STL104507
SMILES CCc1ccc(cc1)n1cc(C(=O)OCc2cc(=O)n3c(n2)cccc3)c2c(c1=O)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 C27H21N3O4 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4/c1-2-18-10-12-20(13-11-18)30-16-23(21-7-3-4-8-22(21)26(30)32)27(33)34-17-19-15-25(31)29-14-6-5-9-24(29)28-19/h3-16H,2,17H2,1H3InChIKey
LEDZAZKTBYPLJB-UHFFFAOYSA-NSynonyms
1226453-89-9(4oxo4Hpyrido(12a)pyrimidin2yl)methyl2(4ethylphenyl)1oxo12dihydroisoquinoline4carboxylate
(4oxopyrido(12a)pyrimidin2yl)methyl2(4ethylphenyl)1oxoisoquinoline4carboxylate
1226453899
CCC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)OCC4=CC(=O)N5C=CC=CC5=N4
InChI=1SC27H21N3O4c1218101220(131118)301623(21734822(21)26(30)32)27(33)3417191525(31)291465924(29)2819h316H217H21H3
MFCD16639597
ZINC000044167284
ZINC44167284
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