Vitas-M small molecule compound

4-{[(3-methylthiophen-2-yl)methyl]amino}benzoic acid

Catalog ID
STK280255
SMILES OC(=O)c1ccc(cc1)NCc1sccc1C

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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 C13H13NO2S MW 247.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO2S/c1-9-6-7-17-12(9)8-14-11-4-2-10(3-5-11)13(15)16/h2-7,14H,8H2,1H3,(H,15,16)
InChIKey
PVOPXJDFVBSJES-UHFFFAOYSA-N
Synonyms
869950-51-6
4(((3METHYL2THIENYL)METHYL)AMINO)BENZOICACID
4(((3METHYLTHIOPHEN2YL)METHYL)AMINO)BENZOICACID
4((3METHYLTHIOPHEN2YL)METHYLAMINO)BENZOICACID
4((3METHYLTHIOPHEN2YLMETHYL)AMINO)BENZOICACID
869950516
CC1=C(SC=C1)CNC2=CC=C(C=C2)C(=O)O
InChI=1SC13H13NO2Sc19671712(9)814114210(3511)13(15)16h2714H8H21H3(H1516)
MFCD07391531
ZINC000004897211
ZINC4897211

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Available files

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