3-nitro-4-[2-oxidanylidene-2-[[2-(oxolan-2-ylmethylcarbamoyl)phenyl]amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[[2-(oxolan-2-ylmethylcarbamoyl)phenyl]amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[2-(tetrahydrofuran-2-ylmethylcarbamoyl)anilino]ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-[2-[oxo-(2-oxolanylmethylamino)methyl]anilino]ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-[2-(oxolan-2-ylmethylcarbamoyl)anilino]ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-[2-(tetrahydrofurfurylcarbamoyl)anilino]ethyl]thio]-3-nitro-benzamide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O6S/c22-20(27)13-7-8-18(17(10-13)25(29)30)32-12-19(26)24-16-6-2-1-5-15(16)21(28)23-11-14-4-3-9-31-14/h1-2,5-8,10,14H,3-4,9,11-12H2,(H2,22,27)(H,23,28)(H,24,26)