methyl 3-[(4-methylsulfanylphenyl)methylamino]benzoate

Systemtic Name: methyl 3-[(4-methylsulfanylphenyl)methylamino]benzoate Openeye Name: methyl 3-[(4-methylsulfanylphenyl)methylamino]benzoate CAS Name: 3-[[4-(methylthio)phenyl]methylamino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-methylsulfanylphenyl)methylamino]benzoate Traditional Name: 3-[[4-(methylthio)benzyl]amino]benzoic acid methyl ester Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NCC2=CC=C(C=C2)SC

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NCC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H17NO2S/c1-19-16(18)13-4-3-5-14(10-13)17-11-12-6-8-15(20-2)9-7-12/h3-10,17H,11H2,1-2H3