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

Systemtic Name: 2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-5-phenyl-1,3-benzoxazole Openeye Name: 2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-5-phenyl-1,3-benzoxazole CAS Name: 2-[5-(1H-benzimidazol-2-ylthio)pentylthio]-5-phenyl-1,3-benzoxazole IUPAC Name: 2-[5-(1H-benzimidazol-2-ylsulfanyl)pentylsulfanyl]-5-phenyl-1,3-benzoxazole Traditional Name: 2-[5-(1H-benzimidazol-2-ylthio)pentylthio]-5-phenyl-1,3-benzoxazole Formula: C25H23N3OS2 MolecularWeight: 445.59962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)SCCCCCSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)SCCCCCSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H23N3OS2/c1-3-9-18(10-4-1)19-13-14-23-22(17-19)28-25(29-23)31-16-8-2-7-15-30-24-26-20-11-5-6-12-21(20)27-24/h1,3-6,9-14,17H,2,7-8,15-16H2,(H,26,27)