3-iodanyl-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 3-iodo-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]benzamide CAS Name: 3-iodo-N-[(2-methoxy-4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-iodo-N-[(2-methoxy-4-nitro-phenyl)thiocarbamoyl]benzamide Formula: C15H12IN3O4S MolecularWeight: 457.24295

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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