N-[5-ethyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiophen-2-yl]benzamide

Systemtic Name: N-[5-ethyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiophen-2-yl]benzamide Openeye Name: N-[5-ethyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-thienyl]benzamide CAS Name: N-[5-ethyl-3-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-thiophenyl]benzamide IUPAC Name: N-[5-ethyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiophen-2-yl]benzamide Traditional Name: N-[5-ethyl-3-[(4-phenylpiperazin-1-ium-1-yl)methyl]-2-thienyl]benzamide Formula: C24H28N3OS+ MolecularWeight: 406.56362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3OS/c1-2-22-17-20(24(29-22)25-23(28)19-9-5-3-6-10-19)18-26-13-15-27(16-14-26)21-11-7-4-8-12-21/h3-12,17H,2,13-16,18H2,1H3,(H,25,28)/p+1