6-[(4-tert-butylphenyl)methylsulfanyl]-3-fluoranyl-2,2-dimethyl-chromene

Systemtic Name: 6-[(4-tert-butylphenyl)methylsulfanyl]-3-fluoranyl-2,2-dimethyl-chromene Openeye Name: 6-[(4-tert-butylphenyl)methylsulfanyl]-3-fluoranyl-2,2-dimethyl-chromene CAS Name: 6-[(4-tert-butylphenyl)methylthio]-3-fluoranyl-2,2-dimethyl-1-benzopyran IUPAC Name: 6-[(4-tert-butylphenyl)methylsulfanyl]-3-fluoranyl-2,2-dimethylchromene Traditional Name: 6-[(4-tert-butylbenzyl)thio]-3-fluoranyl-2,2-dimethyl-chromene Formula: C22H25FOS MolecularWeight: 355.499238

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CC2=C(O1)C=CC(=C2)SCC3=CC=C(C=C3)C(C)(C)C)F)C

Isomeric SMILES

CC1(C(=CC2=C(O1)C=CC(=C2)SCC3=CC=C(C=C3)C(C)(C)C)[18F])C

InChI

InChI=1S/C22H25FOS/c1-21(2,3)17-8-6-15(7-9-17)14-25-18-10-11-19-16(12-18)13-20(23)22(4,5)24-19/h6-13H,14H2,1-5H3/i23-1