N-(benzamidocarbamothioyl)-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-(benzamidocarbamothioyl)-3-iodanyl-4-methyl-benzamide Openeye Name: N-(benzamidocarbamothioyl)-3-iodo-4-methyl-benzamide CAS Name: N-[(benzoylhydrazo)-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-(benzamidocarbamothioyl)-3-iodo-4-methylbenzamide Traditional Name: N-(benzamidothiocarbamoyl)-3-iodo-4-methyl-benzamide Formula: C16H14IN3O2S MolecularWeight: 439.27073

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14IN3O2S/c1-10-7-8-12(9-13(10)17)14(21)18-16(23)20-19-15(22)11-5-3-2-4-6-11/h2-9H,1H3,(H,19,22)(H2,18,20,21,23)