(5-methyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester IUPAC Name: (5-methyl-1,3,4-oxadiazol-2-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CC1=NN=C(O1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C18H13N3O3S/c1-12-20-21-17(24-12)11-23-18(22)14-7-3-5-9-16(14)25-15-8-4-2-6-13(15)10-19/h2-9H,11H2,1H3