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

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-2-chloranyl-5-iodanyl-benzamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-2-chloro-5-iodo-benzamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-2-chloro-5-iodobenzamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-2-chloro-5-iodobenzamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-2-chloro-5-iodo-benzamide Formula: C16H13ClIN3O2S MolecularWeight: 473.71579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClIN3O2S/c1-9(22)19-11-3-5-12(6-4-11)20-16(24)21-15(23)13-8-10(18)2-7-14(13)17/h2-8H,1H3,(H,19,22)(H2,20,21,23,24)