6-ethynyl-7-fluoranyl-2,2-dimethyl-4-(4-methylphenyl)thiochromene

Systemtic Name: 6-ethynyl-7-fluoranyl-2,2-dimethyl-4-(4-methylphenyl)thiochromene Openeye Name: 6-ethynyl-7-fluoro-2,2-dimethyl-4-(p-tolyl)thiochromene CAS Name: 6-ethynyl-7-fluoro-2,2-dimethyl-4-(4-methylphenyl)-1-benzothiopyran IUPAC Name: 6-ethynyl-7-fluoro-2,2-dimethyl-4-(4-methylphenyl)thiochromene Traditional Name: 6-ethynyl-7-fluoro-2,2-dimethyl-4-(p-tolyl)thiochromene Formula: C20H17FS MolecularWeight: 308.412383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(SC3=C2C=C(C(=C3)F)C#C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(SC3=C2C=C(C(=C3)F)C#C)(C)C

InChI

InChI=1S/C20H17FS/c1-5-14-10-16-17(15-8-6-13(2)7-9-15)12-20(3,4)22-19(16)11-18(14)21/h1,6-12H,2-4H3