ethyl 3-(3-methylsulfanylpropylamino)benzoate

Systemtic Name: ethyl 3-(3-methylsulfanylpropylamino)benzoate Openeye Name: ethyl 3-(3-methylsulfanylpropylamino)benzoate CAS Name: 3-[3-(methylthio)propylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(3-methylsulfanylpropylamino)benzoate Traditional Name: 3-[3-(methylthio)propylamino]benzoic acid ethyl ester Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NCCCSC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NCCCSC

InChI

InChI=1S/C13H19NO2S/c1-3-16-13(15)11-6-4-7-12(10-11)14-8-5-9-17-2/h4,6-7,10,14H,3,5,8-9H2,1-2H3