Vitas-M small molecule compound
3,11-bis(1,3-benzodioxol-5-ylmethyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK616572
SMILES Cc1nc2c(c(=O)n1Cc1ccc3c(c1)OCO3)c1c(n2Cc2ccc3c(c2)OCO3)nc2c(n1)cccc2
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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 C29H21N5O5 MW 519.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N5O5/c1-16-30-27-25(29(35)33(16)12-17-6-8-21-23(10-17)38-14-36-21)26-28(32-20-5-3-2-4-19(20)31-26)34(27)13-18-7-9-22-24(11-18)39-15-37-22/h2-11H,12-15H2,1H3InChIKey
AVLLOZMOWISSQX-UHFFFAOYSA-NSynonyms
381712-23-8311bis(13benzodioxol5ylmethyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
311bis(benzo(d)(13)dioxol5ylmethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
381712238
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC6=C(C=C5)OCO6)C(=O)N1CC7=CC8=C(C=C7)OCO8
InChI=1SC29H21N5O5c116302725(29(35)33(16)1217682123(1017)38143621)2628(3220532419(20)3126)34(27)1318792224(1118)39153722h211H1215H21H3
MFCD02997916
ZINC000009169005
ZINC09169005
ZINC9169005
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