N-[4-[1-(4-bromophenyl)ethylcarbamothioylamino]phenyl]-2-iodanyl-benzamide

Systemtic Name: N-[4-[1-(4-bromophenyl)ethylcarbamothioylamino]phenyl]-2-iodanyl-benzamide Openeye Name: N-[4-[1-(4-bromophenyl)ethylcarbamothioylamino]phenyl]-2-iodo-benzamide CAS Name: N-[4-[[[1-(4-bromophenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-2-iodobenzamide IUPAC Name: N-[4-[1-(4-bromophenyl)ethylcarbamothioylamino]phenyl]-2-iodobenzamide Traditional Name: N-[4-[1-(4-bromophenyl)ethylthiocarbamoylamino]phenyl]-2-iodo-benzamide Formula: C22H19BrIN3OS MolecularWeight: 580.27923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C22H19BrIN3OS/c1-14(15-6-8-16(23)9-7-15)25-22(29)27-18-12-10-17(11-13-18)26-21(28)19-4-2-3-5-20(19)24/h2-14H,1H3,(H,26,28)(H2,25,27,29)