2-butyl-2-(4-ethynylphenyl)-1,3-dithiane

Systemtic Name: 2-butyl-2-(4-ethynylphenyl)-1,3-dithiane Openeye Name: 2-butyl-2-(4-ethynylphenyl)-1,3-dithiane CAS Name: 2-butyl-2-(4-ethynylphenyl)-1,3-dithiane IUPAC Name: 2-butyl-2-(4-ethynylphenyl)-1,3-dithiane Traditional Name: 2-butyl-2-(4-ethynylphenyl)-1,3-dithiane Formula: C16H20S2 MolecularWeight: 276.46

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(SCCCS1)C2=CC=C(C=C2)C#C

Isomeric SMILES

CCCCC1(SCCCS1)C2=CC=C(C=C2)C#C

InChI

InChI=1S/C16H20S2/c1-3-5-11-16(17-12-6-13-18-16)15-9-7-14(4-2)8-10-15/h2,7-10H,3,5-6,11-13H2,1H3