N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-1-benzothiophene-3-carboxamide

Systemtic Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-1-benzothiophene-3-carboxamide Openeye Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]benzothiophene-3-carboxamide CAS Name: N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]-1-benzothiophene-3-carboxamide IUPAC Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-1-benzothiophene-3-carboxamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]benzothiophene-3-carboxamide Formula: C21H24N3OS+ MolecularWeight: 366.49976

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C21H23N3OS/c1-23-10-12-24(13-11-23)17-8-6-16(7-9-17)14-22-21(25)19-15-26-20-5-3-2-4-18(19)20/h2-9,15H,10-14H2,1H3,(H,22,25)/p+1