N-(dibenzofuran-3-ylcarbamothioyl)-4-methoxy-3-nitro-benzamide

Systemtic Name: N-(dibenzofuran-3-ylcarbamothioyl)-4-methoxy-3-nitro-benzamide Openeye Name: N-(dibenzofuran-3-ylcarbamothioyl)-4-methoxy-3-nitro-benzamide CAS Name: N-[(3-dibenzofuranylamino)-sulfanylidenemethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-(dibenzofuran-3-ylcarbamothioyl)-4-methoxy-3-nitrobenzamide Traditional Name: N-(dibenzofuran-3-ylthiocarbamoyl)-4-methoxy-3-nitro-benzamide Formula: C21H15N3O5S MolecularWeight: 421.4259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)C4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)C4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O5S/c1-28-18-9-6-12(10-16(18)24(26)27)20(25)23-21(30)22-13-7-8-15-14-4-2-3-5-17(14)29-19(15)11-13/h2-11H,1H3,(H2,22,23,25,30)