Vitas-M small molecule compound
3-(2-methoxyethyl)-11-{[(E)-thiophen-2-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL232426
SMILES COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cccs1
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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 C20H16N6O2S MW 404.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6O2S/c1-28-9-8-25-12-21-18-16(20(25)27)17-19(24-15-7-3-2-6-14(15)23-17)26(18)22-11-13-5-4-10-29-13/h2-7,10-12H,8-9H2,1H3/b22-11+InChIKey
BBGDKIRSPZDKDQ-SSDVNMTOSA-NSynonyms
861109-50-4(E)3(2methoxyethyl)11((thiophen2ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2methoxyethyl)11(((E)thiophen2ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861109504
COCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC=CS5
COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccs1
InChI=1SC20H16N6O2Sc128982512211816(20(25)27)1719(2415732614(15)2317)26(18)22111354102913h271012H89H21H3b2211+
MFCD04181680
ZINC000002245149
ZINC33351480
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