methyl 5-azanyl-2-phenylsulfanyl-benzoate

Systemtic Name: methyl 5-azanyl-2-phenylsulfanyl-benzoate Openeye Name: methyl 5-amino-2-phenylsulfanyl-benzoate CAS Name: 5-amino-2-(phenylthio)benzoic acid methyl ester IUPAC Name: methyl 5-amino-2-phenylsulfanylbenzoate Traditional Name: 5-amino-2-(phenylthio)benzoic acid methyl ester Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)N)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)N)SC2=CC=CC=C2

InChI

InChI=1S/C14H13NO2S/c1-17-14(16)12-9-10(15)7-8-13(12)18-11-5-3-2-4-6-11/h2-9H,15H2,1H3