1-[(2-fluorophenyl)methyl]-4-isothiocyanato-pyrazole

Systemtic Name: 1-[(2-fluorophenyl)methyl]-4-isothiocyanato-pyrazole Openeye Name: 1-[(2-fluorophenyl)methyl]-4-isothiocyanato-pyrazole CAS Name: 1-[(2-fluorophenyl)methyl]-4-isothiocyanatopyrazole IUPAC Name: 1-[(2-fluorophenyl)methyl]-4-isothiocyanatopyrazole Traditional Name: 1-(2-fluorobenzyl)-4-isothiocyanato-pyrazole Formula: C11H8FN3S MolecularWeight: 233.264723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8FN3S/c12-11-4-2-1-3-9(11)6-15-7-10(5-14-15)13-8-16/h1-5,7H,6H2