Vitas-M small molecule compound
3-benzyl-11-(4-phenoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK534468
SMILES O=c1n(cnc2c1c1nc3ccccc3nc1n2c1ccc(cc1)Oc1ccccc1)Cc1ccccc1
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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 C31H21N5O2 MW 495.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21N5O2/c37-31-27-28-30(34-26-14-8-7-13-25(26)33-28)36(29(27)32-20-35(31)19-21-9-3-1-4-10-21)22-15-17-24(18-16-22)38-23-11-5-2-6-12-23/h1-18,20H,19H2InChIKey
NJUBYFPJIPTFNV-UHFFFAOYSA-NSynonyms
3benzyl11(4phenoxyphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3benzyl11(4phenoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
C1=CC=C(C=C1)CN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3C6=CC=C(C=C6)OC7=CC=CC=C7
InChI=1SC31H21N5O2c3731272830(342614871325(26)3328)36(29(27)322035(31)192193141021)22151724(181622)3823115261223h11820H19H2
MFCD02995884
ZINC000002304191
ZINC02304191
ZINC2304191
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