Vitas-M small molecule compound
3-[(4-chlorobenzyl)sulfanyl]-1-(thiophen-2-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK067466
SMILES N#Cc1c(SCc2ccc(cc2)Cl)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 C21H17ClN2S2 MW 396.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2S2/c22-15-9-7-14(8-10-15)13-26-21-18(12-23)16-4-1-2-5-17(16)20(24-21)19-6-3-11-25-19/h3,6-11H,1-2,4-5,13H2InChIKey
OAKYEYASMUODFK-UHFFFAOYSA-NSynonyms
3((4chlorobenzyl)sulfanyl)1(thiophen2yl)5678tetrahydroisoquinoline4carbonitrile
3((4chlorobenzyl)thio)1(thiophen2yl)5678tetrahydroisoquinoline4carbonitrile
3((4chlorophenyl)methylsulfanyl)1thiophen2yl5678tetrahydroisoquinoline4carbonitrile
C1CCC2=C(N=C(C(=C2C1)C#N)SCC3=CC=C(C=C3)Cl)C4=CC=CS4
InChI=1SC21H17ClN2S2c22159714(81015)13262118(1223)16412517(16)20(2421)1963112519h3611H124513H2
MFCD02983648
N#Cc1c(SCc2ccc(cc2)Cl)nc(c2c1CCCC2)c1cccs1
STK067466
ZINC000004598884
ZINC04598884
ZINC4598884
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