4-(4-tert-butylphenyl)sulfanyl-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(4-tert-butylphenyl)sulfanyl-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(4-tert-butylphenyl)sulfanyl-3-fluoro-benzonitrile CAS Name: 4-[(4-tert-butylphenyl)thio]-3-fluorobenzonitrile IUPAC Name: 4-(4-tert-butylphenyl)sulfanyl-3-fluorobenzonitrile Traditional Name: 4-[(4-tert-butylphenyl)thio]-3-fluoro-benzonitrile Formula: C17H16FNS MolecularWeight: 285.379043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C17H16FNS/c1-17(2,3)13-5-7-14(8-6-13)20-16-9-4-12(11-19)10-15(16)18/h4-10H,1-3H3