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

Systemtic Name: 3-chloranyl-4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3-chloro-4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 3-chloro-4-ethoxy-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-chloro-4-ethoxy-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O4S/c1-2-24-14-7-6-10(8-13(14)17)15(21)19-16(25)18-11-4-3-5-12(9-11)20(22)23/h3-9H,2H2,1H3,(H2,18,19,21,25)