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

Systemtic Name: 4-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[3-(4-bromophenyl)-1,2-benzothiazol-6-yl]-2-methyl-but-3-yn-2-ol Formula: C18H14BrNOS MolecularWeight: 372.27886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC2=C(C=C1)C(=NS2)C3=CC=C(C=C3)Br)O

Isomeric SMILES

CC(C)(C#CC1=CC2=C(C=C1)C(=NS2)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C18H14BrNOS/c1-18(2,21)10-9-12-3-8-15-16(11-12)22-20-17(15)13-4-6-14(19)7-5-13/h3-8,11,21H,1-2H3