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

Systemtic Name: methyl 4-[(4-methylsulfanylphenyl)methylamino]benzoate Openeye Name: methyl 4-[(4-methylsulfanylphenyl)methylamino]benzoate CAS Name: 4-[[4-(methylthio)phenyl]methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-methylsulfanylphenyl)methylamino]benzoate Traditional Name: 4-[[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=C(C=C1)NCC2=CC=C(C=C2)SC

Isomeric SMILES

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

InChI

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