N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-3-iodanyl-benzamide

Systemtic Name: N-[[2-chloranyl-5-(propanoylamino)phenyl]carbamothioyl]-3-iodanyl-benzamide Openeye Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-iodo-benzamide CAS Name: N-[[2-chloro-5-(1-oxopropylamino)anilino]-sulfanylidenemethyl]-3-iodobenzamide IUPAC Name: N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-iodobenzamide Traditional Name: N-[(2-chloro-5-propionamido-phenyl)thiocarbamoyl]-3-iodo-benzamide Formula: C17H15ClIN3O2S MolecularWeight: 487.74237

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClIN3O2S/c1-2-15(23)20-12-6-7-13(18)14(9-12)21-17(25)22-16(24)10-4-3-5-11(19)8-10/h3-9H,2H2,1H3,(H,20,23)(H2,21,22,24,25)