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

Systemtic Name: 4-bromanyl-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[(2-ethyl-4-iodo-phenyl)carbamothioyl]benzamide CAS Name: 4-bromo-N-[(2-ethyl-4-iodoanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(2-ethyl-4-iodophenyl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[(2-ethyl-4-iodo-phenyl)thiocarbamoyl]benzamide Formula: C16H14BrIN2OS MolecularWeight: 489.16863

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H14BrIN2OS/c1-2-10-9-13(18)7-8-14(10)19-16(22)20-15(21)11-3-5-12(17)6-4-11/h3-9H,2H2,1H3,(H2,19,20,21,22)