4-isothiocyanato-1-[[2,3,4,6-tetrakis(fluoranyl)phenyl]methyl]pyrazole

Systemtic Name: 4-isothiocyanato-1-[[2,3,4,6-tetrakis(fluoranyl)phenyl]methyl]pyrazole Openeye Name: 4-isothiocyanato-1-[(2,3,4,6-tetrafluorophenyl)methyl]pyrazole CAS Name: 4-isothiocyanato-1-[(2,3,4,6-tetrafluorophenyl)methyl]pyrazole IUPAC Name: 4-isothiocyanato-1-[(2,3,4,6-tetrafluorophenyl)methyl]pyrazole Traditional Name: 4-isothiocyanato-1-(2,3,4,6-tetrafluorobenzyl)pyrazole Formula: C11H5F4N3S MolecularWeight: 287.236113

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1F)F)F)CN2C=C(C=N2)N=C=S)F

Isomeric SMILES

C1=C(C(=C(C(=C1F)F)F)CN2C=C(C=N2)N=C=S)F

InChI

InChI=1S/C11H5F4N3S/c12-8-1-9(13)11(15)10(14)7(8)4-18-3-6(2-17-18)16-5-19/h1-3H,4H2