N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(3-dibenzofuranylamino)-sulfanylidenemethyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(dibenzofuran-3-ylthiocarbamoyl)-3-nitro-4-pyrrolidino-benzamide Formula: C24H20N4O4S MolecularWeight: 460.505

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)C5=CC=CC=C5O4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)C5=CC=CC=C5O4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O4S/c29-23(15-7-10-19(20(13-15)28(30)31)27-11-3-4-12-27)26-24(33)25-16-8-9-18-17-5-1-2-6-21(17)32-22(18)14-16/h1-2,5-10,13-14H,3-4,11-12H2,(H2,25,26,29,33)