N-(4-nitrophenyl)-3-oxidanylidene-2-[(2-sulfanylideneimidazolidin-1-yl)methylidene]butanamide

Systemtic Name: N-(4-nitrophenyl)-3-oxidanylidene-2-[(2-sulfanylideneimidazolidin-1-yl)methylidene]butanamide Openeye Name: N-(4-nitrophenyl)-3-oxo-2-[(2-thioxoimidazolidin-1-yl)methylene]butanamide CAS Name: N-(4-nitrophenyl)-3-oxo-2-[(2-sulfanylidene-1-imidazolidinyl)methylidene]butanamide IUPAC Name: N-(4-nitrophenyl)-3-oxo-2-[(2-sulfanylideneimidazolidin-1-yl)methylidene]butanamide Traditional Name: 2-acetyl-N-(4-nitrophenyl)-3-(2-thioxoimidazolidin-1-yl)acrylamide Formula: C14H14N4O4S MolecularWeight: 334.35036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN1CCNC1=S)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(=CN1CCNC1=S)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O4S/c1-9(19)12(8-17-7-6-15-14(17)23)13(20)16-10-2-4-11(5-3-10)18(21)22/h2-5,8H,6-7H2,1H3,(H,15,23)(H,16,20)