Vitas-M small molecule compound
2-{[1-(4-chlorophenyl)-4-cyano-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Catalog ID
STK036175
SMILES N#Cc1c(SCC(=O)NCCc2ccccc2)nc(c2c1CCCC2)c1ccc(cc1)Cl
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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 C26H24ClN3OS MW 462.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3OS/c27-20-12-10-19(11-13-20)25-22-9-5-4-8-21(22)23(16-28)26(30-25)32-17-24(31)29-15-14-18-6-2-1-3-7-18/h1-3,6-7,10-13H,4-5,8-9,14-15,17H2,(H,29,31)InChIKey
UUUYONVUCCVBNN-UHFFFAOYSA-NSynonyms
2((1(4chlorophenyl)4cyano5678tetrahydroisoquinolin3yl)sulfanyl)N(2phenylethyl)acetamide
C1CCC2=C(N=C(C(=C2C1)C#N)SCC(=O)NCCC3=CC=CC=C3)C4=CC=C(C=C4)Cl
InChI=1SC26H24ClN3OSc2720121019(111320)2522954821(22)23(1628)26(3025)321724(31)291514186213718h13671013H4589141517H2(H2931)
MFCD08050474
N#Cc1c(SCC(=O)NCCc2ccccc2)nc(c2c1CCCC2)c1ccc(cc1)Cl
STK036175
ZINC000009246643
ZINC09246643
ZINC9246643
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