N-(4-iodophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(4-iodophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(4-iodophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(4-iodophenyl)acetamide IUPAC Name: N-(4-iodophenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(4-iodophenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C21H18IN3OS2 MolecularWeight: 519.42159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C21H18IN3OS2/c22-15-9-11-17(12-10-15)23-20(26)14-28-19-8-4-7-18(13-19)25-21(27)24-16-5-2-1-3-6-16/h1-13H,14H2,(H,23,26)(H2,24,25,27)