Vitas-M small molecule compound
methyl 4-{6-[(2-ethoxyphenyl)amino]-10-methyl-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Catalog ID
STL051790
SMILES CCOc1ccccc1Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)c(nn1c1ccccn1)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 C34H29N7O3 MW 583.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H29N7O3/c1-4-44-27-14-8-6-12-25(27)37-31-33-38-32-29(21(2)39-41(32)28-15-9-10-20-35-28)30(22-16-18-23(19-17-22)34(42)43-3)40(33)26-13-7-5-11-24(26)36-31/h5-20,30H,4H2,1-3H3,(H,36,37)InChIKey
OJPWGFBXJYLDPZ-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1NC2=NC3=CC=CC=C3N4C2=NC5=C(C4C6=CC=C(C=C6)C(=O)OC)C(=NN5C7=CC=CC=N7)C
InChI=1SC34H29N7O3c14442714861225(27)373133383229(21(2)3941(32)2815910203528)30(22161823(191722)34(42)433)40(33)2613751124(26)3631h52030H4H213H3(H3637)
methyl4(6((2ethoxyphenyl)amino)10methyl8(pyridin2yl)811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)benzoate
MFCD03692216
ZINC000053290408
ZINC000053290411
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