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

Systemtic Name: N-[(E)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]furan-2-carboxamide Openeye Name: N-[(E)-1-(4-methylpiperazin-4-ium-1-carbonyl)-2-(2-thienyl)vinyl]furan-2-carboxamide CAS Name: N-[(E)-3-(4-methyl-1-piperazin-4-iumyl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-2-furancarboxamide IUPAC Name: N-[(E)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]furan-2-carboxamide Traditional Name: N-[(E)-1-(4-methylpiperazin-4-ium-1-carbonyl)-2-(2-thienyl)vinyl]-2-furamide Formula: C17H20N3O3S+ MolecularWeight: 346.424

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C(=CC2=CC=CS2)NC(=O)C3=CC=CO3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)/C(=C\C2=CC=CS2)/NC(=O)C3=CC=CO3

InChI

InChI=1S/C17H19N3O3S/c1-19-6-8-20(9-7-19)17(22)14(12-13-4-3-11-24-13)18-16(21)15-5-2-10-23-15/h2-5,10-12H,6-9H2,1H3,(H,18,21)/p+1/b14-12+