Vitas-M small molecule compound

methyl 2-{[(4-iodophenoxy)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK957819
SMILES COC(=O)c1c(NC(=O)COc2ccc(cc2)I)sc2c1CCC(C2)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 C19H20INO4S MW 485.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20INO4S/c1-11-3-8-14-15(9-11)26-18(17(14)19(23)24-2)21-16(22)10-25-13-6-4-12(20)5-7-13/h4-7,11H,3,8-10H2,1-2H3,(H,21,22)
InChIKey
AINQMHLNBOOKIK-UHFFFAOYSA-N
Synonyms
438617-40-4
438617404
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=CC=C(C=C3)I
InChI=1SC19H20INO4Sc111381415(911)2618(17(14)19(23)242)2116(22)1025136412(20)5713h4711H3810H212H3(H2122)
methyl2(((4iodophenoxy)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2((2(4iodophenoxy)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD01919874
ZINC000000997978
ZINC000000997979

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Available files

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