N-[(4-benzamidophenyl)carbamothioyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[(4-benzamidophenyl)carbamothioyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[(4-benzamidophenyl)carbamothioyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[(4-benzamidoanilino)-sulfanylidenemethyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[(4-benzamidophenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[(4-benzamidophenyl)thiocarbamoyl]-4-ethoxy-3-nitro-benzamide Formula: C23H20N4O5S MolecularWeight: 464.4937

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O5S/c1-2-32-20-13-8-16(14-19(20)27(30)31)22(29)26-23(33)25-18-11-9-17(10-12-18)24-21(28)15-6-4-3-5-7-15/h3-14H,2H2,1H3,(H,24,28)(H2,25,26,29,33)