methyl 2-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]benzoate

Systemtic Name: methyl 2-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]benzoate Openeye Name: methyl 2-[(5-phenyl-2-thioxo-1,3,4-oxadiazol-3-yl)methylamino]benzoate CAS Name: 2-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-phenyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]benzoate Traditional Name: 2-[(5-phenyl-2-thioxo-1,3,4-oxadiazol-3-yl)methylamino]benzoic acid methyl ester Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NCN2C(=S)OC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NCN2C(=S)OC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O3S/c1-22-16(21)13-9-5-6-10-14(13)18-11-20-17(24)23-15(19-20)12-7-3-2-4-8-12/h2-10,18H,11H2,1H3