Vitas-M small molecule compound
3-hexyl-11-{[(E)-thiophen-2-ylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK587601
SMILES CCCCCCn1cnc2c(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 C23H22N6OS MW 430.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6OS/c1-2-3-4-7-12-28-15-24-21-19(23(28)30)20-22(27-18-11-6-5-10-17(18)26-20)29(21)25-14-16-9-8-13-31-16/h5-6,8-11,13-15H,2-4,7,12H2,1H3/b25-14+InChIKey
MJOMLFSNFFEETA-AFUMVMLFSA-NSynonyms
849911-04-2(E)3hexyl11((thiophen2ylmethylene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3hexyl11(((E)thiophen2ylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
849911042
CCCCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC=CS5
CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccs1
InChI=1SC23H22N6OSc12347122815242119(23(28)30)2022(271811651017(18)2620)29(21)25141698133116h568111315H24712H21H3b2514+
MFCD05688478
ZINC000009510862
ZINC34829246
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