Vitas-M small molecule compound
3-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1-(thiophen-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK354707
SMILES N#Cc1c(SCc2nc3ccccc3[nH]c2=O)nc(c2c1CCCC2)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 C23H18N4OS2 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4OS2/c24-12-16-14-6-1-2-7-15(14)21(20-10-5-11-29-20)27-23(16)30-13-19-22(28)26-18-9-4-3-8-17(18)25-19/h3-5,8-11H,1-2,6-7,13H2,(H,26,28)InChIKey
HCDBZRTWKOJDBJ-UHFFFAOYSA-NSynonyms
710288-16-73(((3oxo34dihydroquinoxalin2yl)methyl)sulfanyl)1(thiophen2yl)5678tetrahydroisoquinoline4carbonitrile
3((3oxo4Hquinoxalin2yl)methylsulfanyl)1thiophen2yl5678tetrahydroisoquinoline4carbonitrile
710288167
C1CCC2=C(N=C(C(=C2C1)C#N)SCC3=NC4=CC=CC=C4NC3=O)C5=CC=CS5
InChI=1SC23H18N4OS2c24121614612715(14)21(20105112920)2723(16)30131922(28)2618943817(18)2519h35811H126713H2(H2628)
MFCD04071536
N#Cc1c(SCc2nc3ccccc3(nH)c2=O)nc(c2c1CCCC2)c1cccs1
ZINC000016525022
ZINC16525022
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