2-chloranyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-5-iodanyl-benzamide

Systemtic Name: 2-chloranyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-5-iodanyl-benzamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-2-chloro-5-iodo-benzamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-2-chloro-5-iodobenzamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-2-chloro-5-iodobenzamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-2-chloro-5-iodo-benzamide Formula: C17H14ClIN4O2S2 MolecularWeight: 532.80613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl

InChI

InChI=1S/C17H14ClIN4O2S2/c1-9(24)20-16(26)21-11-3-5-12(6-4-11)22-17(27)23-15(25)13-8-10(19)2-7-14(13)18/h2-8H,1H3,(H2,20,21,24,26)(H2,22,23,25,27)