6-ethynyl-4,4,7-trimethyl-2,3-dihydrothiochromene

Systemtic Name: 6-ethynyl-4,4,7-trimethyl-2,3-dihydrothiochromene Openeye Name: 6-ethynyl-4,4,7-trimethyl-thiochromane CAS Name: 6-ethynyl-4,4,7-trimethyl-2,3-dihydro-1-benzothiopyran IUPAC Name: 6-ethynyl-4,4,7-trimethyl-2,3-dihydrothiochromene Traditional Name: 6-ethynyl-4,4,7-trimethyl-thiochroman Formula: C14H16S MolecularWeight: 216.34184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C#C)C(CCS2)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C#C)C(CCS2)(C)C

InChI

InChI=1S/C14H16S/c1-5-11-9-12-13(8-10(11)2)15-7-6-14(12,3)4/h1,8-9H,6-7H2,2-4H3