Vitas-M small molecule compound
11-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-3-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK920311
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CC(C)C
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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/c1-16(2)15-32-17(3)28-25-23(27(32)33)24-26(30-20-9-7-6-8-19(20)29-24)31(25)13-12-18-10-11-21(34-4)22(14-18)35-5/h6-11,14,16H,12-13,15H2,1-5H3InChIKey
YGOFQDVMKPDDMU-UHFFFAOYSA-NSynonyms
840461-79-211(2(34dimethoxyphenyl)ethyl)2methyl3(2methylpropyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(34dimethoxyphenethyl)3isobutyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
840461792
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC(=C(C=C5)OC)OC)C(=O)N1CC(C)C
InChI=1SC27H29N5O3c116(2)153217(3)282523(27(32)33)2426(3020976819(20)2924)31(25)131218101121(344)22(1418)355h6111416H121315H215H3
MFCD03695393
ZINC000002258184
ZINC02258184
ZINC2258184
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