2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-[4-(2-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]thio]-1-[4-(2-methoxyphenyl)piperazino]ethanone Formula: C25H25N5O2S MolecularWeight: 459.5633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=C(C=CC=N3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=C(C=CC=N3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H25N5O2S/c1-32-22-11-5-4-10-21(22)29-13-15-30(16-14-29)23(31)17-33-25-18(7-6-12-26-25)24-27-19-8-2-3-9-20(19)28-24/h2-12H,13-17H2,1H3,(H,27,28)