(2-acetamido-1,3-thiazol-4-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C20H15N3O3S2 MolecularWeight: 409.4814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N

InChI

InChI=1S/C20H15N3O3S2/c1-13(24)22-20-23-15(12-27-20)11-26-19(25)16-7-3-5-9-18(16)28-17-8-4-2-6-14(17)10-21/h2-9,12H,11H2,1H3,(H,22,23,24)