Vitas-M small molecule compound

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

Catalog ID
STK355707
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)Nc1sc2c(c1C#N)CCC2

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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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-4-25-16-10-13(11-17(26-5-2)19(16)27-6-3)20(24)23-21-15(12-22)14-8-7-9-18(14)28-21/h10-11H,4-9H2,1-3H3,(H,23,24)
InChIKey
XUHAFKMPMDIAPQ-UHFFFAOYSA-N
Synonyms

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C3=C(S2)CCC3)C#N
InChI=1SC21H24N2O4Sc1425161013(1117(2652)19(16)2763)20(24)232115(1222)1487918(14)2821h1011H49H213H3(H2324)
MFCD03243022
N(3CYANO(456TRIHYDROCYCLOPENTA(12D)THIOPHEN2YL))(345TRIETHOXYPHENYL)CARBOXAMIDE
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)345triethoxybenzamide
ZINC000000803469
ZINC00803469
ZINC803469

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Available files

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