Vitas-M small molecule compound

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-{[3-cyano-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide

Catalog ID
STK999559
SMILES N#Cc1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nc2c(c1c1cccnc1)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 C25H21N5OS2 MW 471.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5OS2/c26-11-18-16-7-3-9-21(16)33-25(18)30-22(31)14-32-24-19(12-27)23(15-5-4-10-28-13-15)17-6-1-2-8-20(17)29-24/h4-5,10,13H,1-3,6-9,14H2,(H,30,31)
InChIKey
ANUWBTSHHDTSIG-UHFFFAOYSA-N
Synonyms
445383-29-9
2((3cyano4(pyridin3yl)5678tetrahydroquinolin2yl)thio)N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)acetamide
445383299
C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)NC3=C(C4=C(S3)CCC4)C#N)C#N)C5=CN=CC=C5
InChI=1SC25H21N5OS2c2611181673921(16)3325(18)3022(31)14322419(1227)23(155410281315)17612820(17)2924h451013H136914H2(H3031)
MFCD03234587
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)2((3cyano4(pyridin3yl)5678tetrahydroquinolin2yl)sulfanyl)acetamide
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)2((3cyano4pyridin3yl5678tetrahydroquinolin2yl)sulfanyl)acetamide
ZINC000008394862
ZINC08394862
ZINC8394862

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.