2-(4-ethynylphenyl)-4,5-dimethyl-1,3-dithiolane

Systemtic Name: 2-(4-ethynylphenyl)-4,5-dimethyl-1,3-dithiolane Openeye Name: 2-(4-ethynylphenyl)-4,5-dimethyl-1,3-dithiolane CAS Name: 2-(4-ethynylphenyl)-4,5-dimethyl-1,3-dithiolane IUPAC Name: 2-(4-ethynylphenyl)-4,5-dimethyl-1,3-dithiolane Traditional Name: 2-(4-ethynylphenyl)-4,5-dimethyl-1,3-dithiolane Formula: C13H14S2 MolecularWeight: 234.38026

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(SC(S1)C2=CC=C(C=C2)C#C)C

Isomeric SMILES

CC1C(SC(S1)C2=CC=C(C=C2)C#C)C

InChI

InChI=1S/C13H14S2/c1-4-11-5-7-12(8-6-11)13-14-9(2)10(3)15-13/h1,5-10,13H,2-3H3