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

Systemtic Name: methyl 4-[(4-azanyl-2-methyl-phenyl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(4-amino-2-methyl-phenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-amino-2-methylphenyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-amino-2-methylphenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(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=C(C=C2)C(=O)OC

Isomeric SMILES

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

InChI

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