2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-[(Z)-1-thiophen-2-ylethylideneamino]ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-[(Z)-1-thiophen-2-ylethylideneamino]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[(Z)-1-(2-thienyl)ethylideneamino]acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazin-1-iumyl]-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[(Z)-1-(2-thienyl)ethylideneamino]acetamide Formula: C19H25N4OS+ MolecularWeight: 357.493

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

C/C(=N/NC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=C2)/C3=CC=CS3

InChI

InChI=1S/C19H24N4OS/c1-16(18-8-5-13-25-18)20-21-19(24)15-23-11-9-22(10-12-23)14-17-6-3-2-4-7-17/h2-8,13H,9-12,14-15H2,1H3,(H,21,24)/p+1/b20-16-