Vitas-M small molecule compound
N-benzyl-2-{[3-cyano-4-(4-methylphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK748772
SMILES N#Cc1c(SCC(=O)NCc2ccccc2)nc2c(c1c1ccc(cc1)C)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 C26H25N3OS MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3OS/c1-18-11-13-20(14-12-18)25-21-9-5-6-10-23(21)29-26(22(25)15-27)31-17-24(30)28-16-19-7-3-2-4-8-19/h2-4,7-8,11-14H,5-6,9-10,16-17H2,1H3,(H,28,30)InChIKey
WLSPLIQEIJDMQZ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2=C(C(=NC3=C2CCCC3)SCC(=O)NCC4=CC=CC=C4)C#N
InChI=1SC26H25N3OSc118111320(141218)25219561023(21)2926(22(25)1527)311724(30)2816197324819h24781114H569101617H21H3(H2830)
MFCD00743832
Nbenzyl2((3cyano4(4methylphenyl)5678tetrahydroquinolin2yl)sulfanyl)acetamide
ZINC000000705938
ZINC00705938
ZINC705938
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