Vitas-M small molecule compound
propyl 4-[3-(3-methylbutyl)-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate
Catalog ID
STK990493
SMILES CCCOC(=O)c1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)CCC(C)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 C27H27N5O3 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3/c1-4-15-35-27(34)18-9-11-19(12-10-18)32-24-22(26(33)31(16-28-24)14-13-17(2)3)23-25(32)30-21-8-6-5-7-20(21)29-23/h5-12,16-17H,4,13-15H2,1-3H3InChIKey
PKMIOMNOHYAUGX-UHFFFAOYSA-NSynonyms
845632-99-7845632997
CCCOC(=O)C1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CCC(C)C
InChI=1SC27H27N5O3c14153527(34)1891119(121018)322422(26(33)31(162824)141317(2)3)2325(32)3021865720(21)2923h5121617H41315H213H3
MFCD04166971
propyl4(3(3methylbutyl)4oxo34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
propyl4(3isopentyl4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
ZINC000002413733
ZINC02413733
ZINC2413733
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