methyl 4-pyridin-2-ylsulfanylcarbonylbenzoate

Systemtic Name: methyl 4-pyridin-2-ylsulfanylcarbonylbenzoate Openeye Name: methyl 4-(2-pyridylsulfanylcarbonyl)benzoate CAS Name: 4-[oxo-(2-pyridinylthio)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-pyridin-2-ylsulfanylcarbonylbenzoate Traditional Name: 4-(2-pyridylthio)carbonylbenzoic acid methyl ester Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)SC2=CC=CC=N2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)SC2=CC=CC=N2

InChI

InChI=1S/C14H11NO3S/c1-18-13(16)10-5-7-11(8-6-10)14(17)19-12-4-2-3-9-15-12/h2-9H,1H3