5-(4-bromophenyl)-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[(2-ethyl-4-iodanyl-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[(2-ethyl-4-iodo-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[(2-ethyl-4-iodoanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[(2-ethyl-4-iodophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[(2-ethyl-4-iodo-phenyl)thiocarbamoyl]-2-furamide Formula: C20H16BrIN2O2S MolecularWeight: 555.22671

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H16BrIN2O2S/c1-2-12-11-15(22)7-8-16(12)23-20(27)24-19(25)18-10-9-17(26-18)13-3-5-14(21)6-4-13/h3-11H,2H2,1H3,(H2,23,24,25,27)