N-[4-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide

Systemtic Name: N-[4-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-1,3-thiazol-2-yl]-N-phenyl-ethanamide Openeye Name: N-[4-[(5-nitro-1,3-dioxo-isoindolin-2-yl)methyl]thiazol-2-yl]-N-phenyl-acetamide CAS Name: N-[4-[(5-nitro-1,3-dioxo-2-isoindolyl)methyl]-2-thiazolyl]-N-phenylacetamide IUPAC Name: N-[4-[(5-nitro-1,3-dioxoisoindol-2-yl)methyl]-1,3-thiazol-2-yl]-N-phenylacetamide Traditional Name: N-[4-[(1,3-diketo-5-nitro-isoindolin-2-yl)methyl]thiazol-2-yl]-N-phenyl-acetamide Formula: C20H14N4O5S MolecularWeight: 422.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1)C2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O5S/c1-12(25)23(14-5-3-2-4-6-14)20-21-13(11-30-20)10-22-18(26)16-8-7-15(24(28)29)9-17(16)19(22)27/h2-9,11H,10H2,1H3