Vitas-M small molecule compound
3-(3-ethoxypropyl)-2-ethyl-11-(2-methoxy-5-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990688
SMILES CCOCCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)ccc1OC
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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 C27H29N5O3 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O3/c1-5-22-30-25-23(27(33)31(22)14-9-15-35-6-2)24-26(29-19-11-8-7-10-18(19)28-24)32(25)20-16-17(3)12-13-21(20)34-4/h7-8,10-13,16H,5-6,9,14-15H2,1-4H3InChIKey
JVAIWJVFUAQPMT-UHFFFAOYSA-NSynonyms
3(3ethoxypropyl)2ethyl11(2methoxy5methylphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=C(C=CC(=C5)C)OC)C(=O)N1CCCOCC
InChI=1SC27H29N5O3c1522302523(27(33)31(22)149153562)2426(291911871018(19)2824)32(25)201617(3)121321(20)344h78101316H5691415H214H3
MFCD05702563
ZINC000006150829
ZINC06150829
ZINC6150829
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