3-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]prop-2-yn-1-ol

Systemtic Name: 3-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]prop-2-yn-1-ol Openeye Name: 3-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]prop-2-yn-1-ol CAS Name: 3-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]-2-propyn-1-ol IUPAC Name: 3-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]prop-2-yn-1-ol Traditional Name: 3-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]prop-2-yn-1-ol Formula: C16H10BrNOS MolecularWeight: 344.2257

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NSC3=C2C=CC(=C3)C#CCO)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NSC3=C2C=CC(=C3)C#CCO)Br

InChI

InChI=1S/C16H10BrNOS/c17-13-6-4-12(5-7-13)16-14-8-3-11(2-1-9-19)10-15(14)20-18-16/h3-8,10,19H,9H2