Vitas-M small molecule compound
11-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL238691
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1ncn(c2=O)CCC(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/c1-17(2)11-13-31-16-28-25-23(27(31)33)24-26(30-20-8-6-5-7-19(20)29-24)32(25)14-12-18-9-10-21(34-3)22(15-18)35-4/h5-10,15-17H,11-14H2,1-4H3InChIKey
WBYGYLAWKWWUNK-UHFFFAOYSA-NSynonyms
847379-66-211(2(34dimethoxyphenyl)ethyl)3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(34dimethoxyphenethyl)3isopentyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
847379662
CC(C)CCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CCC5=CC(=C(C=C5)OC)OC
InChI=1SC27H29N5O3c117(2)11133116282523(27(31)33)2426(3020865719(20)2924)32(25)14121891021(343)22(1518)354h5101517H1114H214H3
MFCD04181678
ZINC000002245148
ZINC02245148
ZINC2245148
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