2-[5-[4-[(4-pyridin-4-ylpiperazin-1-yl)methyl]phenyl]thiophen-2-yl]-1H-benzimidazole

Systemtic Name: 2-[5-[4-[(4-pyridin-4-ylpiperazin-1-yl)methyl]phenyl]thiophen-2-yl]-1H-benzimidazole Openeye Name: 2-[5-[4-[[4-(4-pyridyl)piperazin-1-yl]methyl]phenyl]-2-thienyl]-1H-benzimidazole CAS Name: 2-[5-[4-[(4-pyridin-4-yl-1-piperazinyl)methyl]phenyl]-2-thiophenyl]-1H-benzimidazole IUPAC Name: 2-[5-[4-[(4-pyridin-4-ylpiperazin-1-yl)methyl]phenyl]thiophen-2-yl]-1H-benzimidazole Traditional Name: 2-[5-[4-[[4-(4-pyridyl)piperazino]methyl]phenyl]-2-thienyl]-1H-benzimidazole Formula: C27H25N5S MolecularWeight: 451.5859

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C3=CC=C(S3)C4=NC5=CC=CC=C5N4)C6=CC=NC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C3=CC=C(S3)C4=NC5=CC=CC=C5N4)C6=CC=NC=C6

InChI

InChI=1S/C27H25N5S/c1-2-4-24-23(3-1)29-27(30-24)26-10-9-25(33-26)21-7-5-20(6-8-21)19-31-15-17-32(18-16-31)22-11-13-28-14-12-22/h1-14H,15-19H2,(H,29,30)