5-butyl-1,3-bis(fluoranyl)-2-[4-(4-isothiocyanatophenyl)phenyl]benzene

Systemtic Name: 5-butyl-1,3-bis(fluoranyl)-2-[4-(4-isothiocyanatophenyl)phenyl]benzene Openeye Name: 5-butyl-1,3-difluoro-2-[4-(4-isothiocyanatophenyl)phenyl]benzene CAS Name: 5-butyl-1,3-difluoro-2-[4-(4-isothiocyanatophenyl)phenyl]benzene IUPAC Name: 5-butyl-1,3-difluoro-2-[4-(4-isothiocyanatophenyl)phenyl]benzene Traditional Name: 5-butyl-1,3-difluoro-2-[4-(4-isothiocyanatophenyl)phenyl]benzene Formula: C23H19F2NS MolecularWeight: 379.465466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)C3=CC=C(C=C3)N=C=S)F

Isomeric SMILES

CCCCC1=CC(=C(C(=C1)F)C2=CC=C(C=C2)C3=CC=C(C=C3)N=C=S)F

InChI

InChI=1S/C23H19F2NS/c1-2-3-4-16-13-21(24)23(22(25)14-16)19-7-5-17(6-8-19)18-9-11-20(12-10-18)26-15-27/h5-14H,2-4H2,1H3