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

Systemtic Name: N-[(4-bromanyl-2-iodanyl-phenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(4-bromo-2-iodo-phenyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[(4-bromo-2-iodoanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(4-bromo-2-iodophenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[(4-bromo-2-iodo-phenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C14H9BrIN3O3S MolecularWeight: 506.11303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9BrIN3O3S/c15-9-4-5-12(11(16)7-9)17-14(23)18-13(20)8-2-1-3-10(6-8)19(21)22/h1-7H,(H2,17,18,20,23)