2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-1,3-benzoxazole CAS Name: 2-[5-(1H-benzimidazol-2-ylthio)pentylthio]-1,3-benzoxazole IUPAC Name: 2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[5-(1H-benzimidazol-2-ylthio)pentylthio]-1,3-benzoxazole Formula: C19H19N3OS2 MolecularWeight: 369.50366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCCCSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCCCSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H19N3OS2/c1(6-12-24-18-20-14-8-2-3-9-15(14)21-18)7-13-25-19-22-16-10-4-5-11-17(16)23-19/h2-5,8-11H,1,6-7,12-13H2,(H,20,21)