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

Systemtic Name: 3-iodanyl-N-(3-methoxypropylcarbamothioyl)-4-methyl-benzamide Openeye Name: 3-iodo-N-(3-methoxypropylcarbamothioyl)-4-methyl-benzamide CAS Name: 3-iodo-N-[(3-methoxypropylamino)-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-iodo-N-(3-methoxypropylcarbamothioyl)-4-methylbenzamide Traditional Name: 3-iodo-N-(3-methoxypropylthiocarbamoyl)-4-methyl-benzamide Formula: C13H17IN2O2S MolecularWeight: 392.25575

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NCCCOC)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NCCCOC)I

InChI

InChI=1S/C13H17IN2O2S/c1-9-4-5-10(8-11(9)14)12(17)16-13(19)15-6-3-7-18-2/h4-5,8H,3,6-7H2,1-2H3,(H2,15,16,17,19)