3-iodanyl-4-methoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3-iodo-4-methoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide CAS Name: 3-iodo-4-methoxy-N-[(3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-iodo-4-methoxy-N-[(3-nitrophenyl)thiocarbamoyl]benzamide Formula: C15H12IN3O4S MolecularWeight: 457.24295

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12IN3O4S/c1-23-13-6-5-9(7-12(13)16)14(20)18-15(24)17-10-3-2-4-11(8-10)19(21)22/h2-8H,1H3,(H2,17,18,20,24)