Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4-dimethylbenzamide

Catalog ID
STK412660
SMILES N#Cc1c(NC(=O)c2ccc(c(c2)C)C)sc2c1CCCC2

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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 C18H18N2OS MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS/c1-11-7-8-13(9-12(11)2)17(21)20-18-15(10-19)14-5-3-4-6-16(14)22-18/h7-9H,3-6H2,1-2H3,(H,20,21)
InChIKey
JHPCSRBBCYQHKS-UHFFFAOYSA-N
Synonyms
443122-35-8
443122358
CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)C
InChI=1SC18H18N2OSc1117813(912(11)2)17(21)201815(1019)14534616(14)2218h79H36H212H3(H2021)
MFCD01984350
N(3cyano4567tetrahydro1benzothiophen2yl)34dimethylbenzamide
ZINC000000514055
ZINC00514055
ZINC514055

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Available files

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