N-[(2,5-dimethylphenyl)carbamothioyl]-3-iodanyl-benzamide

Systemtic Name: N-[(2,5-dimethylphenyl)carbamothioyl]-3-iodanyl-benzamide Openeye Name: N-[(2,5-dimethylphenyl)carbamothioyl]-3-iodo-benzamide CAS Name: N-[(2,5-dimethylanilino)-sulfanylidenemethyl]-3-iodobenzamide IUPAC Name: N-[(2,5-dimethylphenyl)carbamothioyl]-3-iodobenzamide Traditional Name: N-[(2,5-dimethylphenyl)thiocarbamoyl]-3-iodo-benzamide Formula: C16H15IN2OS MolecularWeight: 410.27257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC(=O)C2=CC(=CC=C2)I

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C16H15IN2OS/c1-10-6-7-11(2)14(8-10)18-16(21)19-15(20)12-4-3-5-13(17)9-12/h3-9H,1-2H3,(H2,18,19,20,21)