methyl 4-(4-azanyl-3-cyano-phenyl)sulfanylbenzoate

Systemtic Name: methyl 4-(4-azanyl-3-cyano-phenyl)sulfanylbenzoate Openeye Name: methyl 4-(4-amino-3-cyano-phenyl)sulfanylbenzoate CAS Name: 4-[(4-amino-3-cyanophenyl)thio]benzoic acid methyl ester IUPAC Name: methyl 4-(4-amino-3-cyanophenyl)sulfanylbenzoate Traditional Name: 4-[(4-amino-3-cyano-phenyl)thio]benzoic acid methyl ester Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O2S/c1-19-15(18)10-2-4-12(5-3-10)20-13-6-7-14(17)11(8-13)9-16/h2-8H,17H2,1H3