N-(2-methoxyphenyl)-2-[(6-nitro-2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-3-oxidanylidene-butanamide

Systemtic Name: N-(2-methoxyphenyl)-2-[(6-nitro-2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-3-oxidanylidene-butanamide Openeye Name: N-(2-methoxyphenyl)-2-[(6-nitro-2-thioxo-3H-benzimidazol-1-yl)methylene]-3-oxo-butanamide CAS Name: N-(2-methoxyphenyl)-2-[(6-nitro-2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-3-oxobutanamide IUPAC Name: N-(2-methoxyphenyl)-2-[(6-nitro-2-sulfanylidene-3H-benzimidazol-1-yl)methylidene]-3-oxobutanamide Traditional Name: 2-acetyl-N-(2-methoxyphenyl)-3-(6-nitro-2-thioxo-3H-benzimidazol-1-yl)acrylamide Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN1C2=C(C=CC(=C2)[N+](=O)[O-])NC1=S)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC(=O)C(=CN1C2=C(C=CC(=C2)[N+](=O)[O-])NC1=S)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C19H16N4O5S/c1-11(24)13(18(25)20-15-5-3-4-6-17(15)28-2)10-22-16-9-12(23(26)27)7-8-14(16)21-19(22)29/h3-10H,1-2H3,(H,20,25)(H,21,29)