Vitas-M small molecule compound

N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,4,5-trimethoxybenzamide

Catalog ID
STK418753
SMILES COc1cc(cc(c1OC)OC)C(=O)Nc1sc(c(c1C#N)CC)C

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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 C18H20N2O4S MW 360.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S/c1-6-12-10(2)25-18(13(12)9-19)20-17(21)11-7-14(22-3)16(24-5)15(8-11)23-4/h7-8H,6H2,1-5H3,(H,20,21)
InChIKey
IIRNTOBYCKUDTR-UHFFFAOYSA-N
Synonyms
352679-01-7
352679017
CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C
InChI=1SC18H20N2O4Sc161210(2)2518(13(12)919)2017(21)11714(223)16(245)15(811)234h78H6H215H3(H2021)
MFCD01341706
N(3cyano4ethyl5methylthiophen2yl)345trimethoxybenzamide
ZINC000001200004
ZINC01200004
ZINC1200004

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Available files

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