6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(methylsulfanylmethyl)-1H-benzimidazole

Systemtic Name: 6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(methylsulfanylmethyl)-1H-benzimidazole Openeye Name: 6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(methylsulfanylmethyl)-1H-benzimidazole CAS Name: 6-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-2-[(methylthio)methyl]-1H-benzimidazole IUPAC Name: 6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-2-(methylsulfanylmethyl)-1H-benzimidazole Traditional Name: 6-[2-[4-(2-methoxyphenyl)piperazino]ethyl]-2-[(methylthio)methyl]-1H-benzimidazole Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCC3=CC4=C(C=C3)N=C(N4)CSC

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCC3=CC4=C(C=C3)N=C(N4)CSC

InChI

InChI=1S/C22H28N4OS/c1-27-21-6-4-3-5-20(21)26-13-11-25(12-14-26)10-9-17-7-8-18-19(15-17)24-22(23-18)16-28-2/h3-8,15H,9-14,16H2,1-2H3,(H,23,24)