2-(3-tert-butyl-4-prop-1-ynyl-phenyl)-1,3-dithiane

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

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=C(C=C(C=C1)C2SCCCS2)C(C)(C)C

Isomeric SMILES

CC#CC1=C(C=C(C=C1)C2SCCCS2)C(C)(C)C

InChI

InChI=1S/C17H22S2/c1-5-7-13-8-9-14(12-15(13)17(2,3)4)16-18-10-6-11-19-16/h8-9,12,16H,6,10-11H2,1-4H3