Vitas-M small molecule compound
ethyl 3-(3-cyclopentyl-2-methyl-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl)benzoate
Catalog ID
STK714205
SMILES CCOC(=O)c1cccc(c1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCC1
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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 C27H25N5O3 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O3/c1-3-35-27(34)17-9-8-12-19(15-17)32-24-22(23-25(32)30-21-14-7-6-13-20(21)29-23)26(33)31(16(2)28-24)18-10-4-5-11-18/h6-9,12-15,18H,3-5,10-11H2,1-2H3InChIKey
GFDMDWLUXHUHKZ-UHFFFAOYSA-NSynonyms
836645-42-2836645422
CCOC(=O)C1=CC(=CC=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)C6CCCC6
ethyl3(3cyclopentyl2methyl4oxo34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
ethyl3(3cyclopentyl2methyl4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
InChI=1SC27H25N5O3c133527(34)17981219(1517)322422(2325(32)302114761320(21)2923)26(33)31(16(2)2824)1810451118h69121518H351011H212H3
MFCD03691509
ZINC000002253202
ZINC02253202
ZINC2253202
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