Vitas-M small molecule compound
3-[(2-oxopropyl)sulfanyl]-1-(thiophen-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK166691
SMILES N#Cc1c(SCC(=O)C)nc(c2c1CCCC2)c1cccs1
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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 C17H16N2OS2 MW 328.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2OS2/c1-11(20)10-22-17-14(9-18)12-5-2-3-6-13(12)16(19-17)15-7-4-8-21-15/h4,7-8H,2-3,5-6,10H2,1H3InChIKey
CEHZHRAPPKVBSR-UHFFFAOYSA-NSynonyms
3((2oxopropyl)sulfanyl)1(thiophen2yl)5678tetrahydroisoquinoline4carbonitrile
3(2oxopropylsulfanyl)1thiophen2yl5678tetrahydroisoquinoline4carbonitrile
CC(=O)CSC1=NC(=C2CCCCC2=C1C#N)C3=CC=CS3
InChI=1SC17H16N2OS2c111(20)10221714(918)12523613(12)16(1917)157482115h478H235610H21H3
MFCD06642654
ZINC000004702706
ZINC04702706
ZINC4702706
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