Vitas-M small molecule compound

2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(4-fluorophenyl)acetamide

Catalog ID
STK166485
SMILES N#Cc1c(SCC(=O)Nc2ccc(cc2)F)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 C19H18FN3OS MW 355.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18FN3OS/c1-12-15-4-2-3-5-16(15)17(10-21)19(22-12)25-11-18(24)23-14-8-6-13(20)7-9-14/h6-9H,2-5,11H2,1H3,(H,23,24)
InChIKey
LNRRFNAURIUBDL-UHFFFAOYSA-N
Synonyms
607696-82-2
2((4cyano1methyl5678tetrahydroisoquinolin3yl)sulfanyl)N(4fluorophenyl)acetamide
2((4cyano1methyl5678tetrahydroisoquinolin3yl)thio)N(4fluorophenyl)acetamide
607696822
CC1=C2CCCCC2=C(C(=N1)SCC(=O)NC3=CC=C(C=C3)F)C#N
InChI=1SC19H18FN3OSc11215423516(15)17(1021)19(2212)251118(24)23148613(20)7914h69H2511H21H3(H2324)
MFCD03033488
ZINC000001471617
ZINC01471617
ZINC1471617

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.