methyl 4-[1-(4-methylsulfanylphenyl)ethylamino]benzoate

Systemtic Name: methyl 4-[1-(4-methylsulfanylphenyl)ethylamino]benzoate Openeye Name: methyl 4-[1-(4-methylsulfanylphenyl)ethylamino]benzoate CAS Name: 4-[1-[4-(methylthio)phenyl]ethylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-methylsulfanylphenyl)ethylamino]benzoate Traditional Name: 4-[1-[4-(methylthio)phenyl]ethylamino]benzoic acid methyl ester Formula: C17H19NO2S MolecularWeight: 301.40326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H19NO2S/c1-12(13-6-10-16(21-3)11-7-13)18-15-8-4-14(5-9-15)17(19)20-2/h4-12,18H,1-3H3