methyl 3-azanyl-2-(phenylmethyl)-4-sulfanyl-benzoate

Systemtic Name: methyl 3-azanyl-2-(phenylmethyl)-4-sulfanyl-benzoate Openeye Name: methyl 3-amino-2-benzyl-4-sulfanyl-benzoate CAS Name: 3-amino-4-mercapto-2-(phenylmethyl)benzoic acid methyl ester IUPAC Name: methyl 3-amino-2-benzyl-4-sulfanylbenzoate Traditional Name: 3-amino-2-benzyl-4-mercapto-benzoic acid methyl ester Formula: C15H15NO2S MolecularWeight: 273.3501

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)S)N)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)S)N)CC2=CC=CC=C2

InChI

InChI=1S/C15H15NO2S/c1-18-15(17)11-7-8-13(19)14(16)12(11)9-10-5-3-2-4-6-10/h2-8,19H,9,16H2,1H3