methyl 3-[(4-azanyl-2-methyl-phenyl)sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[(4-azanyl-2-methyl-phenyl)sulfanylmethyl]benzoate Openeye Name: methyl 3-[(4-amino-2-methyl-phenyl)sulfanylmethyl]benzoate CAS Name: 3-[[(4-amino-2-methylphenyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-amino-2-methylphenyl)sulfanylmethyl]benzoate Traditional Name: 3-[[(4-amino-2-methyl-phenyl)thio]methyl]benzoic acid methyl ester Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC2=CC=CC(=C2)C(=O)OC

InChI

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