Vitas-M small molecule compound
11-(3-chloro-4-methylphenyl)-3-(3-ethoxypropyl)-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990673
SMILES CCOCCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)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/c1-4-21-30-24-22(26(33)31(21)13-8-14-34-5-2)23-25(29-20-10-7-6-9-19(20)28-23)32(24)17-12-11-16(3)18(27)15-17/h6-7,9-12,15H,4-5,8,13-14H2,1-3H3InChIKey
WWGMUGIQQCODKL-UHFFFAOYSA-NSynonyms
11(3chloro4methylphenyl)3(3ethoxypropyl)2ethyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)C)Cl)C(=O)N1CCCOCC
InChI=1SC26H26ClN5O2c1421302422(26(33)31(21)138143452)2325(29201076919(20)2823)32(24)17121116(3)18(27)1517h6791215H4581314H213H3
MFCD05697400
ZINC000006150794
ZINC06150794
ZINC6150794
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