2-[2-(4-bromophenyl)ethynyl]-5-tert-butyl-1,3-dithiane

Systemtic Name: 2-[2-(4-bromophenyl)ethynyl]-5-tert-butyl-1,3-dithiane Openeye Name: 2-[2-(4-bromophenyl)ethynyl]-5-tert-butyl-1,3-dithiane CAS Name: 2-[2-(4-bromophenyl)ethynyl]-5-tert-butyl-1,3-dithiane IUPAC Name: 2-[2-(4-bromophenyl)ethynyl]-5-tert-butyl-1,3-dithiane Traditional Name: 2-[2-(4-bromophenyl)ethynyl]-5-tert-butyl-1,3-dithiane Formula: C16H19BrS2 MolecularWeight: 355.35606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CSC(SC1)C#CC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)C1CSC(SC1)C#CC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H19BrS2/c1-16(2,3)13-10-18-15(19-11-13)9-6-12-4-7-14(17)8-5-12/h4-5,7-8,13,15H,10-11H2,1-3H3