Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-methyl-11-(4-phenoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL032879
SMILES Cc1nc2n(c3ccc(cc3)Oc3ccccc3)c3c(c2c(=O)n1Cc1ccc2c(c1)OCO2)nc1c(n3)cccc1
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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 C33H23N5O4 MW 553.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H23N5O4/c1-20-34-31-29(33(39)37(20)18-21-11-16-27-28(17-21)41-19-40-27)30-32(36-26-10-6-5-9-25(26)35-30)38(31)22-12-14-24(15-13-22)42-23-7-3-2-4-8-23/h2-17H,18-19H2,1H3InChIKey
RZMBOYYJMXHZOB-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)2methyl11(4phenoxyphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(benzo(d)(13)dioxol5ylmethyl)2methyl11(4phenoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)OC6=CC=CC=C6)C(=O)N1CC7=CC8=C(C=C7)OCO8
InChI=1SC33H23N5O4c120343129(33(39)37(20)182111162728(1721)41194027)3032(36261065925(26)3530)38(31)22121424(151322)42237324823h217H1819H21H3
MFCD02987280
ZINC000098000175
ZINC98000175
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