5-[(E)-2-(4-ethylphenyl)ethenyl]-1,3-bis(fluoranyl)-2-isothiocyanato-benzene

Systemtic Name: 5-[(E)-2-(4-ethylphenyl)ethenyl]-1,3-bis(fluoranyl)-2-isothiocyanato-benzene Openeye Name: 5-[(E)-2-(4-ethylphenyl)vinyl]-1,3-difluoro-2-isothiocyanato-benzene CAS Name: 5-[(E)-2-(4-ethylphenyl)ethenyl]-1,3-difluoro-2-isothiocyanatobenzene IUPAC Name: 5-[(E)-2-(4-ethylphenyl)ethenyl]-1,3-difluoro-2-isothiocyanatobenzene Traditional Name: 5-[(E)-2-(4-ethylphenyl)vinyl]-1,3-difluoro-2-isothiocyanato-benzene Formula: C17H13F2NS MolecularWeight: 301.353626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC2=CC(=C(C(=C2)F)N=C=S)F

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C2=CC(=C(C(=C2)F)N=C=S)F

InChI

InChI=1S/C17H13F2NS/c1-2-12-3-5-13(6-4-12)7-8-14-9-15(18)17(20-11-21)16(19)10-14/h3-10H,2H2,1H3/b8-7+