N-[6-(1H-benzimidazol-2-ylsulfanyl)hexyl]-1,3-benzoxazol-2-amine

Systemtic Name: N-[6-(1H-benzimidazol-2-ylsulfanyl)hexyl]-1,3-benzoxazol-2-amine Openeye Name: N-[6-(1H-benzimidazol-2-ylsulfanyl)hexyl]-1,3-benzoxazol-2-amine CAS Name: N-[6-(1H-benzimidazol-2-ylthio)hexyl]-1,3-benzoxazol-2-amine IUPAC Name: N-[6-(1H-benzimidazol-2-ylsulfanyl)hexyl]-1,3-benzoxazol-2-amine Traditional Name: 6-(1H-benzimidazol-2-ylthio)hexyl-(1,3-benzoxazol-2-yl)amine Formula: C20H22N4OS MolecularWeight: 366.47988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCCCCNC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCCCCNC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H22N4OS/c1(7-13-21-19-22-17-11-5-6-12-18(17)25-19)2-8-14-26-20-23-15-9-3-4-10-16(15)24-20/h3-6,9-12H,1-2,7-8,13-14H2,(H,21,22)(H,23,24)