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

Systemtic Name: (4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoate Openeye Name: (4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)acetic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)acetic acid (4-acetamidophenyl) ester Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)CSCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)CSCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H16N2O3S2/c1-12(21)19-13-6-8-14(9-7-13)23-18(22)11-24-10-17-20-15-4-2-3-5-16(15)25-17/h2-9H,10-11H2,1H3,(H,19,21)