N-[(E)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-1-(4-methylpiperazin-4-ium-1-carbonyl)-2-(2-thienyl)vinyl]benzamide CAS Name: N-[(E)-3-(4-methyl-1-piperazin-4-iumyl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-1-(4-methylpiperazin-4-ium-1-carbonyl)-2-(2-thienyl)vinyl]benzamide Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C(=CC2=CC=CS2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)/C(=C\C2=CC=CS2)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-21-9-11-22(12-10-21)19(24)17(14-16-8-5-13-25-16)20-18(23)15-6-3-2-4-7-15/h2-8,13-14H,9-12H2,1H3,(H,20,23)/p+1/b17-14+