Vitas-M small molecule compound

ethyl 2-({3-[4-(propan-2-yl)phenyl]propanoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STL288098
SMILES CCOC(=O)c1c(NC(=O)CCc2ccc(cc2)C(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 C23H29NO3S MW 399.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO3S/c1-4-27-23(26)21-18-7-5-6-8-19(18)28-22(21)24-20(25)14-11-16-9-12-17(13-10-16)15(2)3/h9-10,12-13,15H,4-8,11,14H2,1-3H3,(H,24,25)
InChIKey
GJAVIHRBDUKTJG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC3=CC=C(C=C3)C(C)C
ethyl2((3(4(propan2yl)phenyl)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3(4propan2ylphenyl)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H29NO3Sc142723(26)2118756819(18)2822(21)2420(25)14111691217(131016)15(2)3h910121315H481114H213H3(H2425)
MFCD08812526
ZINC000010333068
ZINC10333068

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Available files

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