1-[(4-fluorophenyl)methyl]-N-[1-(2-isothiocyanatoethyl)piperidin-4-yl]benzimidazol-2-amine

Systemtic Name: 1-[(4-fluorophenyl)methyl]-N-[1-(2-isothiocyanatoethyl)piperidin-4-yl]benzimidazol-2-amine Openeye Name: 1-[(4-fluorophenyl)methyl]-N-[1-(2-isothiocyanatoethyl)-4-piperidyl]benzimidazol-2-amine CAS Name: 1-[(4-fluorophenyl)methyl]-N-[1-(2-isothiocyanatoethyl)-4-piperidinyl]-2-benzimidazolamine IUPAC Name: 1-[(4-fluorophenyl)methyl]-N-[1-(2-isothiocyanatoethyl)piperidin-4-yl]benzimidazol-2-amine Traditional Name: [1-(4-fluorobenzyl)benzimidazol-2-yl]-[1-(2-isothiocyanatoethyl)-4-piperidyl]amine Formula: C22H24FN5S MolecularWeight: 409.522863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CCN=C=S

Isomeric SMILES

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CCN=C=S

InChI

InChI=1S/C22H24FN5S/c23-18-7-5-17(6-8-18)15-28-21-4-2-1-3-20(21)26-22(28)25-19-9-12-27(13-10-19)14-11-24-16-29/h1-8,19H,9-15H2,(H,25,26)