Vitas-M small molecule compound
3-[(2-chlorobenzyl)sulfanyl]-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK081563
SMILES N#Cc1c(SCc2ccccc2Cl)nc(c2c1CCCC2)C
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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 C18H17ClN2S MW 328.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2S/c1-12-14-7-3-4-8-15(14)16(10-20)18(21-12)22-11-13-6-2-5-9-17(13)19/h2,5-6,9H,3-4,7-8,11H2,1H3InChIKey
TWKXZPDTNHMMNV-UHFFFAOYSA-NSynonyms
3((2chlorobenzyl)sulfanyl)1methyl5678tetrahydroisoquinoline4carbonitrile
3((2chlorobenzyl)thio)1methyl5678tetrahydroisoquinoline4carbonitrile
3((2chlorophenyl)methylsulfanyl)1methyl5678tetrahydroisoquinoline4carbonitrile
CC1=C2CCCCC2=C(C(=N1)SCC3=CC=CC=C3Cl)C#N
InChI=1SC18H17ClN2Sc11214734815(14)16(1020)18(2112)221113625917(13)19h2569H347811H21H3
MFCD02328734
N#Cc1c(SCc2ccccc2Cl)nc(c2c1CCCC2)C
STK081563
ZINC000000086780
ZINC00086780
ZINC86780
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