Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-11-(3,5-dimethylphenyl)-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL154676
SMILES CCc1nc2c(c(=O)n1Cc1ccc3c(c1)OCO3)c1c(n2c2cc(C)cc(c2)C)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 C30H25N5O3 MW 503.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O3/c1-4-25-33-28-26(30(36)34(25)15-19-9-10-23-24(14-19)38-16-37-23)27-29(32-22-8-6-5-7-21(22)31-27)35(28)20-12-17(2)11-18(3)13-20/h5-14H,4,15-16H2,1-3H3InChIKey
BQWJODHXUCDWSZ-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)11(35dimethylphenyl)2ethyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(benzo(d)(13)dioxol5ylmethyl)11(35dimethylphenyl)2ethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=CC(=C5)C)C)C(=O)N1CC6=CC7=C(C=C6)OCO7
InChI=1SC30H25N5O3c1425332826(30(36)34(25)15199102324(1419)38163723)2729(3222865721(22)3127)35(28)201217(2)1118(3)1320h514H41516H213H3
MFCD02997308
ZINC000002306574
ZINC02306574
ZINC2306574
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