(2-cyanophenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)ethanoate Openeye Name: (2-cyanophenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(1,3-benzoxazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzoxazol-2-ylthio)acetic acid (2-cyanobenzyl) ester Formula: C17H12N2O3S MolecularWeight: 324.35378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CSC2=NC3=CC=CC=C3O2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CSC2=NC3=CC=CC=C3O2)C#N

InChI

InChI=1S/C17H12N2O3S/c18-9-12-5-1-2-6-13(12)10-21-16(20)11-23-17-19-14-7-3-4-8-15(14)22-17/h1-8H,10-11H2