6-ethynyl-2,2-dimethyl-4-(4-propan-2-ylphenyl)thiochromene

Systemtic Name: 6-ethynyl-2,2-dimethyl-4-(4-propan-2-ylphenyl)thiochromene Openeye Name: 6-ethynyl-4-(4-isopropylphenyl)-2,2-dimethyl-thiochromene CAS Name: 6-ethynyl-2,2-dimethyl-4-(4-propan-2-ylphenyl)-1-benzothiopyran IUPAC Name: 6-ethynyl-2,2-dimethyl-4-(4-propan-2-ylphenyl)thiochromene Traditional Name: 6-ethynyl-2,2-dimethyl-4-p-cumenyl-thiochromene Formula: C22H22S MolecularWeight: 318.47508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CC(SC3=C2C=C(C=C3)C#C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CC(SC3=C2C=C(C=C3)C#C)(C)C

InChI

InChI=1S/C22H22S/c1-6-16-7-12-21-19(13-16)20(14-22(4,5)23-21)18-10-8-17(9-11-18)15(2)3/h1,7-15H,2-5H3