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

Systemtic Name: N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[(3-dibenzofuranylamino)-sulfanylidenemethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(dibenzofuran-3-ylcarbamothioyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(dibenzofuran-3-ylthiocarbamoyl)-3-nitro-4-piperidino-benzamide Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)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(CC1)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/C25H22N4O4S/c30-24(16-8-11-20(21(14-16)29(31)32)28-12-4-1-5-13-28)27-25(34)26-17-9-10-19-18-6-2-3-7-22(18)33-23(19)15-17/h2-3,6-11,14-15H,1,4-5,12-13H2,(H2,26,27,30,34)