Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-[(4-propylphenoxy)methyl]benzamide

Catalog ID
STK959356
SMILES CCCc1ccc(cc1)OCc1ccc(cc1)C(=O)Nc1sc2c(c1C#N)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 C26H26N2O2S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2S/c1-2-5-18-10-14-21(15-11-18)30-17-19-8-12-20(13-9-19)25(29)28-26-23(16-27)22-6-3-4-7-24(22)31-26/h8-15H,2-7,17H2,1H3,(H,28,29)
InChIKey
HCMGLAPIZHKWBI-UHFFFAOYSA-N
Synonyms
438531-73-8
438531738
CCCC1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC26H26N2O2Sc12518101421(151118)30171981220(13919)25(29)282623(1627)22634724(22)3126h815H2717H21H3(H2829)
MFCD02056097
N(3cyano4567tetrahydro1benzothiophen2yl)4((4propylphenoxy)methyl)benzamide
ZINC000008455842
ZINC08455842
ZINC8455842

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Available files

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