(2-oxidanylidene-2-phenylazanyl-ethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (2-anilino-2-keto-ethyl) ester Formula: C17H14N2O3S2 MolecularWeight: 358.43466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O3S2/c20-15(18-12-6-2-1-3-7-12)10-22-16(21)11-23-17-19-13-8-4-5-9-14(13)24-17/h1-9H,10-11H2,(H,18,20)