(4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: (4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: (4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (4-acetamidophenyl) ester Formula: C17H14N2O3S2 MolecularWeight: 358.43466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O3S2/c1-11(20)18-12-6-8-13(9-7-12)22-16(21)10-23-17-19-14-4-2-3-5-15(14)24-17/h2-9H,10H2,1H3,(H,18,20)