Vitas-M small molecule compound
1-(4-methylphenyl)-3-sulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK535884
SMILES N#Cc1c(S)nc(c2c1CCCC2)c1ccc(cc1)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 C17H16N2S MW 280.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2S/c1-11-6-8-12(9-7-11)16-14-5-3-2-4-13(14)15(10-18)17(20)19-16/h6-9H,2-5H2,1H3,(H,19,20)InChIKey
WSBLVDBNRGBMFY-UHFFFAOYSA-NSynonyms
129340-04-11(4methylphenyl)3sulfanyl5678tetrahydroisoquinoline4carbonitrile
1(4methylphenyl)3sulfanylidene5678tetrahydro2Hisoquinoline4carbonitrile
129340041
3mercapto1(ptolyl)5678tetrahydroisoquinoline4carbonitrile
CC1=CC=C(C=C1)C2=C3CCCCC3=C(C(=S)N2)C#N
InChI=1SC17H16N2Sc1116812(9711)1614532413(14)15(1018)17(20)1916h69H25H21H3(H1920)
MFCD02984094
ZINC000008462605
ZINC8462605
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