N-(4-nitrophenyl)-3-oxidanylidene-2-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]butanamide

Systemtic Name: N-(4-nitrophenyl)-3-oxidanylidene-2-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]butanamide Openeye Name: N-(4-nitrophenyl)-3-oxo-2-[(2-thioxo-3H-benzimidazol-1-yl)methylene]butanamide CAS Name: N-(4-nitrophenyl)-3-oxo-2-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]butanamide IUPAC Name: N-(4-nitrophenyl)-3-oxo-2-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]butanamide Traditional Name: 2-acetyl-N-(4-nitrophenyl)-3-(2-thioxo-3H-benzimidazol-1-yl)acrylamide Formula: C18H14N4O4S MolecularWeight: 382.39316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN1C2=CC=CC=C2NC1=S)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(=CN1C2=CC=CC=C2NC1=S)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O4S/c1-11(23)14(10-21-16-5-3-2-4-15(16)20-18(21)27)17(24)19-12-6-8-13(9-7-12)22(25)26/h2-10H,1H3,(H,19,24)(H,20,27)