N-[5-ethyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]thiophen-2-yl]benzamide

Systemtic Name: N-[5-ethyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]thiophen-2-yl]benzamide Openeye Name: N-[5-ethyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-2-thienyl]benzamide CAS Name: N-[5-ethyl-3-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-2-thiophenyl]benzamide IUPAC Name: N-[5-ethyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]thiophen-2-yl]benzamide Traditional Name: N-[5-ethyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-2-thienyl]benzamide Formula: C19H27N3OS+2 MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C19H25N3OS/c1-3-17-13-16(14-22-11-9-21(2)10-12-22)19(24-17)20-18(23)15-7-5-4-6-8-15/h4-8,13H,3,9-12,14H2,1-2H3,(H,20,23)/p+2