(4-cyanophenyl)methyl 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: (4-cyanophenyl)methyl 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: (4-cyanophenyl)methyl 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid (4-cyanobenzyl) ester Formula: C22H14N2O2S MolecularWeight: 370.42376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)C(=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H14N2O2S/c23-13-15-9-11-16(12-10-15)14-26-22(25)18-6-2-1-5-17(18)21-24-19-7-3-4-8-20(19)27-21/h1-12H,14H2