(5E)-2-(4-ethanoylpiperazin-1-yl)-5-[(3-nitrophenyl)methylidene]-1,3-thiazol-4-one

Systemtic Name: (5E)-2-(4-ethanoylpiperazin-1-yl)-5-[(3-nitrophenyl)methylidene]-1,3-thiazol-4-one Openeye Name: (5E)-2-(4-acetylpiperazin-1-yl)-5-[(3-nitrophenyl)methylene]thiazol-4-one CAS Name: (5E)-2-(4-acetyl-1-piperazinyl)-5-[(3-nitrophenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-(4-acetylpiperazin-1-yl)-5-[(3-nitrophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-(4-acetylpiperazino)-5-(3-nitrobenzylidene)-2-thiazolin-4-one Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])S2

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=O)/C(=C\C3=CC(=CC=C3)[N+](=O)[O-])/S2

InChI

InChI=1S/C16H16N4O4S/c1-11(21)18-5-7-19(8-6-18)16-17-15(22)14(25-16)10-12-3-2-4-13(9-12)20(23)24/h2-4,9-10H,5-8H2,1H3/b14-10+