N-[4-[4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[4-[(1-methyl-2-benzimidazolyl)methyl]-1-piperazin-4-iumyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-4-ium-1-yl]phenyl]thiophene-2-carboxamide Formula: C24H26N5OS+ MolecularWeight: 432.56114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C[NH+]3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=CC=CS5

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C[NH+]3CCN(CC3)C4=CC=C(C=C4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C24H25N5OS/c1-27-21-6-3-2-5-20(21)26-23(27)17-28-12-14-29(15-13-28)19-10-8-18(9-11-19)25-24(30)22-7-4-16-31-22/h2-11,16H,12-15,17H2,1H3,(H,25,30)/p+1