Vitas-M small molecule compound

propan-2-yl 4-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)amino]benzoate

Catalog ID
STK451451
SMILES CC(OC(=O)c1ccc(cc1)NC(=O)c1csc2c1CCCC2)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 C19H21NO3S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO3S/c1-12(2)23-19(22)13-7-9-14(10-8-13)20-18(21)16-11-24-17-6-4-3-5-15(16)17/h7-12H,3-6H2,1-2H3,(H,20,21)
InChIKey
RSLXVZIIGDWZGS-UHFFFAOYSA-N
Synonyms

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C2=CSC3=C2CCCC3
InChI=1SC19H21NO3Sc112(2)2319(22)137914(10813)2018(21)16112417643515(16)17h712H36H212H3(H2021)
MFCD02606399
propan2yl4((4567tetrahydro1benzothiophen3ylcarbonyl)amino)benzoate
propan2yl4(4567tetrahydro1benzothiophene3carbonylamino)benzoate
ZINC000000999900
ZINC00999900
ZINC999900

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Available files

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