Vitas-M small molecule compound

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1,2-dihydroacenaphthylene-5-carboxamide

Catalog ID
STL291143
SMILES N#Cc1c(sc2c1CCC2)NC(=O)c1ccc2c3c1cccc3CC2

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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 C21H16N2OS MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2OS/c22-11-17-14-4-2-6-18(14)25-21(17)23-20(24)16-10-9-13-8-7-12-3-1-5-15(16)19(12)13/h1,3,5,9-10H,2,4,6-8H2,(H,23,24)
InChIKey
VULQNKXKXXPBKR-UHFFFAOYSA-N
Synonyms

C1CC2=C(C1)SC(=C2C#N)NC(=O)C3=C4C=CC=C5C4=C(CC5)C=C3
InChI=1SC21H16N2OSc2211171442618(14)2521(17)2320(24)1610913871231515(16)19(12)13h135910H2468H2(H2324)
MFCD10474597
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)12dihydroacenaphthylene5carboxamide
ZINC000008379859
ZINC8379859

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Available files

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