Vitas-M small molecule compound

2-{[(4-methoxyphenyl)acetyl]amino}-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK487344
SMILES CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)Cc1ccc(cc1)OC

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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 C21H26N2O3S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3S/c1-3-4-13-7-10-16-17(11-13)27-21(19(16)20(22)25)23-18(24)12-14-5-8-15(26-2)9-6-14/h5-6,8-9,13H,3-4,7,10-12H2,1-2H3,(H2,22,25)(H,23,24)
InChIKey
IPBDKFRTOOIFBR-UHFFFAOYSA-N
Synonyms

2(((4methoxyphenyl)acetyl)amino)6propyl4567tetrahydro1benzothiophene3carboxamide
2((2(4methoxyphenyl)acetyl)amino)6propyl4567tetrahydro1benzothiophene3carboxamide
CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CC3=CC=C(C=C3)OC
InChI=1SC21H26N2O3Sc134137101617(1113)2721(19(16)20(22)25)2318(24)12145815(262)9614h568913H3471012H212H3(H22225)(H2324)
MFCD03374273
ZINC000006045197
ZINC000006046015

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Available files

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