N-[1-[[5-(2-azanylethylsulfanylmethyl)furan-2-yl]methyl]piperidin-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine

Systemtic Name: N-[1-[[5-(2-azanylethylsulfanylmethyl)furan-2-yl]methyl]piperidin-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine Openeye Name: N-[1-[[5-(2-aminoethylsulfanylmethyl)-2-furyl]methyl]-4-piperidyl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine CAS Name: N-[1-[[5-[(2-aminoethylthio)methyl]-2-furanyl]methyl]-4-piperidinyl]-1-[(4-fluorophenyl)methyl]-2-benzimidazolamine IUPAC Name: N-[1-[[5-(2-aminoethylsulfanylmethyl)furan-2-yl]methyl]piperidin-4-yl]-1-[(4-fluorophenyl)methyl]benzimidazol-2-amine Traditional Name: [1-[[5-[(2-aminoethylthio)methyl]-2-furyl]methyl]-4-piperidyl]-[1-(4-fluorobenzyl)benzimidazol-2-yl]amine Formula: C27H32FN5OS MolecularWeight: 493.639283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CC5=CC=C(O5)CSCCN

Isomeric SMILES

C1CN(CCC1NC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F)CC5=CC=C(O5)CSCCN

InChI

InChI=1S/C27H32FN5OS/c28-21-7-5-20(6-8-21)17-33-26-4-2-1-3-25(26)31-27(33)30-22-11-14-32(15-12-22)18-23-9-10-24(34-23)19-35-16-13-29/h1-10,22H,11-19,29H2,(H,30,31)