N-(3-cyanothiophen-2-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-(3-cyano-2-thienyl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(3-cyano-2-thiophenyl)-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(3-cyanothiophen-2-yl)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-(3-cyano-2-thienyl)-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C18H21N4OS+ MolecularWeight: 341.45054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=C(C=CS2)C#N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=C(C=CS2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4OS/c19-14-15-7-13-24-18(15)20-17(23)6-8-21-9-11-22(12-10-21)16-4-2-1-3-5-16/h1-5,7,13H,6,8-12H2,(H,20,23)/p+1