2-bromanyl-3,3,3-triphenyl-propanethioic S-acid

Systemtic Name: 2-bromanyl-3,3,3-triphenyl-propanethioic S-acid Openeye Name: 2-bromo-3,3,3-triphenyl-propanethioic S-acid CAS Name: 2-bromo-3,3,3-triphenylpropanethioic S-acid IUPAC Name: 2-bromo-3,3,3-triphenylpropanethioic S-acid Traditional Name: 2-bromo-3,3,3-triphenyl-thiopropionic acid Formula: C21H17BrOS MolecularWeight: 397.32808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(C(=O)S)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(C(=O)S)Br

InChI

InChI=1S/C21H17BrOS/c22-19(20(23)24)21(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H,(H,23,24)