Vitas-M small molecule compound
2-{[4-cyano-1-(thiophen-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Catalog ID
STK049847
SMILES COc1ccccc1NC(=O)CSc1nc(c2cccs2)c2c(c1C#N)CCCC2
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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 C23H21N3O2S2 MW 435.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S2/c1-28-19-10-5-4-9-18(19)25-21(27)14-30-23-17(13-24)15-7-2-3-8-16(15)22(26-23)20-11-6-12-29-20/h4-6,9-12H,2-3,7-8,14H2,1H3,(H,25,27)InChIKey
GVYJYKGTDFXNLT-UHFFFAOYSA-NSynonyms
2((4cyano1(thiophen2yl)5678tetrahydroisoquinolin3yl)sulfanyl)N(2methoxyphenyl)acetamide
2((4cyano1thiophen2yl5678tetrahydroisoquinolin3yl)sulfanyl)N(2methoxyphenyl)acetamide
COC1=CC=CC=C1NC(=O)CSC2=NC(=C3CCCCC3=C2C#N)C4=CC=CS4
COc1ccccc1NC(=O)CSc1nc(c2cccs2)c2c(c1C#N)CCCC2
InChI=1SC23H21N3O2S2c128191054918(19)2521(27)14302317(1324)15723816(15)22(2623)20116122920h46912H237814H21H3(H2527)
MFCD08051051
STK049847
ZINC000009435173
ZINC09435173
ZINC9435173
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