2-[4-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propoxy]phenyl]-1H-benzimidazole

Systemtic Name: 2-[4-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propoxy]phenyl]-1H-benzimidazole Openeye Name: 2-[4-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propoxy]phenyl]-1H-benzimidazole CAS Name: 2-[4-[3-[4-[2-(propylthio)phenyl]-1-piperazinyl]propoxy]phenyl]-1H-benzimidazole IUPAC Name: 2-[4-[3-[4-(2-propylsulfanylphenyl)piperazin-1-yl]propoxy]phenyl]-1H-benzimidazole Traditional Name: 2-[4-[3-[4-[2-(propylthio)phenyl]piperazino]propoxy]phenyl]-1H-benzimidazole Formula: C29H34N4OS MolecularWeight: 486.67146

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=CC=C1N2CCN(CC2)CCCOC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CCCSC1=CC=CC=C1N2CCN(CC2)CCCOC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C29H34N4OS/c1-2-22-35-28-11-6-5-10-27(28)33-19-17-32(18-20-33)16-7-21-34-24-14-12-23(13-15-24)29-30-25-8-3-4-9-26(25)31-29/h3-6,8-15H,2,7,16-22H2,1H3,(H,30,31)