Vitas-M small molecule compound
3-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1-ethyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK069118
SMILES N#Cc1c(SCc2cc3OCOc3cc2Cl)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 C20H19ClN2O2S MW 386.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2O2S/c1-2-17-14-6-4-3-5-13(14)15(9-22)20(23-17)26-10-12-7-18-19(8-16(12)21)25-11-24-18/h7-8H,2-6,10-11H2,1H3InChIKey
JUWPYJHOSDVHNA-UHFFFAOYSA-NSynonyms
371124-87-73(((6chloro13benzodioxol5yl)methyl)sulfanyl)1ethyl5678tetrahydroisoquinoline4carbonitrile
3(((6chlorobenzo(d)(13)dioxol5yl)methyl)thio)1ethyl5678tetrahydroisoquinoline4carbonitrile
3((6chloro13benzodioxol5yl)methylsulfanyl)1ethyl5678tetrahydroisoquinoline4carbonitrile
371124877
CCC1=C2CCCCC2=C(C(=N1)SCC3=CC4=C(C=C3Cl)OCO4)C#N
InChI=1SC20H19ClN2O2Sc121714643513(14)15(922)20(2317)26101271819(816(12)21)25112418h78H261011H21H3
MFCD03007909
N#Cc1c(SCc2cc3OCOc3cc2Cl)nc(c2c1CCCC2)CC
STK069118
ZINC000001240487
ZINC01240487
ZINC1240487
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