Vitas-M small molecule compound

3-{[2-(dimethylamino)ethyl]sulfanyl}-1-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Catalog ID
STK603941
SMILES N#Cc1c(SCCN(C)C)nc(c2c1CCCC2)N1CCOCC1

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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 C18H26N4OS MW 346.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N4OS/c1-21(2)9-12-24-18-16(13-19)14-5-3-4-6-15(14)17(20-18)22-7-10-23-11-8-22/h3-12H2,1-2H3
InChIKey
PTWJPAUSIFDETI-UHFFFAOYSA-N
Synonyms
903850-66-8
3((2(dimethylamino)ethyl)sulfanyl)1(morpholin4yl)5678tetrahydroisoquinoline4carbonitrile
3((2(dimethylamino)ethyl)thio)1morpholino5678tetrahydroisoquinoline4carbonitrile
3(2(dimethylamino)ethylsulfanyl)1morpholin4yl5678tetrahydroisoquinoline4carbonitrile
903850668
CN(C)CCSC1=NC(=C2CCCCC2=C1C#N)N3CCOCC3
InChI=1SC18H26N4OSc121(2)912241816(1319)14534615(14)17(2018)227102311822h312H212H3
MFCD08293159
ZINC000006764555
ZINC6764555

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Available files

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