[2-(2-bromophenyl)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: [2-(2-bromophenyl)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(2-bromophenyl)-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-(2-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-bromophenyl)-2-oxoethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-(2-bromophenyl)-2-keto-ethyl] ester Formula: C17H12BrNO3S2 MolecularWeight: 422.31608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO3S2/c18-12-6-2-1-5-11(12)14(20)9-22-16(21)10-23-17-19-13-7-3-4-8-15(13)24-17/h1-8H,9-10H2