4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 4-ethoxy-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-ethoxy-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4S/c1-2-23-14-8-6-11(7-9-14)15(20)18-16(24)17-12-4-3-5-13(10-12)19(21)22/h3-10H,2H2,1H3,(H2,17,18,20,24)