5-tert-butyl-2-(4-prop-1-ynylphenyl)-1,3-dithiane

Systemtic Name: 5-tert-butyl-2-(4-prop-1-ynylphenyl)-1,3-dithiane Openeye Name: 5-tert-butyl-2-(4-prop-1-ynylphenyl)-1,3-dithiane CAS Name: 5-tert-butyl-2-(4-prop-1-ynylphenyl)-1,3-dithiane IUPAC Name: 5-tert-butyl-2-(4-prop-1-ynylphenyl)-1,3-dithiane Traditional Name: 5-tert-butyl-2-(4-prop-1-ynylphenyl)-1,3-dithiane Formula: C17H22S2 MolecularWeight: 290.48658

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC=C(C=C1)C2SCC(CS2)C(C)(C)C

Isomeric SMILES

CC#CC1=CC=C(C=C1)C2SCC(CS2)C(C)(C)C

InChI

InChI=1S/C17H22S2/c1-5-6-13-7-9-14(10-8-13)16-18-11-15(12-19-16)17(2,3)4/h7-10,15-16H,11-12H2,1-4H3