Vitas-M small molecule compound
1-ethyl-3-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK060850
SMILES N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc(c2c1CCCC2)CC
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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 C23H20N2O3S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O3S/c1-2-19-16-9-5-4-8-15(16)18(12-24)22(25-19)29-13-20(26)17-11-14-7-3-6-10-21(14)28-23(17)27/h3,6-7,10-11H,2,4-5,8-9,13H2,1H3InChIKey
GZAOLZIVCBYUFJ-UHFFFAOYSA-NSynonyms
315245-95-51ethyl3((2oxo2(2oxo2Hchromen3yl)ethyl)sulfanyl)5678tetrahydroisoquinoline4carbonitrile
1ethyl3((2oxo2(2oxo2Hchromen3yl)ethyl)thio)5678tetrahydroisoquinoline4carbonitrile
1ethyl3(2oxo2(2oxochromen3yl)ethyl)sulfanyl5678tetrahydroisoquinoline4carbonitrile
315245955
CCC1=C2CCCCC2=C(C(=N1)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N
InChI=1SC23H20N2O3Sc121916954815(16)18(1224)22(2519)291320(26)1711147361021(14)2823(17)27h3671011H2458913H21H3
MFCD01162219
N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc(c2c1CCCC2)CC
STK060850
ZINC000000625540
ZINC00625540
ZINC625540
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