Vitas-M small molecule compound
11-(3-chloro-4-methoxyphenyl)-2-ethyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990682
SMILES COc1ccc(cc1Cl)n1c2nc(CC)n(c(=O)c2c2c1nc1ccccc1n2)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 C26H26ClN5O2 MW 475.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5O2/c1-5-21-30-24-22(26(33)31(21)13-12-15(2)3)23-25(29-19-9-7-6-8-18(19)28-23)32(24)16-10-11-20(34-4)17(27)14-16/h6-11,14-15H,5,12-13H2,1-4H3InChIKey
UZLPPPURSGQQTI-UHFFFAOYSA-NSynonyms
11(3chloro4methoxyphenyl)2ethyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)OC)Cl)C(=O)N1CCC(C)C
InChI=1SC26H26ClN5O2c1521302422(26(33)31(21)131215(2)3)2325(2919976818(19)2823)32(24)16101120(344)17(27)1416h6111415H51213H214H3
MFCD05703338
ZINC000006150819
ZINC06150819
ZINC6150819
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