N-(furan-2-ylmethylcarbamothioyl)-3-iodanyl-4-methoxy-benzamide

Systemtic Name: N-(furan-2-ylmethylcarbamothioyl)-3-iodanyl-4-methoxy-benzamide Openeye Name: N-(2-furylmethylcarbamothioyl)-3-iodo-4-methoxy-benzamide CAS Name: N-[(2-furanylmethylamino)-sulfanylidenemethyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-(furan-2-ylmethylcarbamothioyl)-3-iodo-4-methoxybenzamide Traditional Name: N-(2-furfurylthiocarbamoyl)-3-iodo-4-methoxy-benzamide Formula: C14H13IN2O3S MolecularWeight: 416.23409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CO2)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CO2)I

InChI

InChI=1S/C14H13IN2O3S/c1-19-12-5-4-9(7-11(12)15)13(18)17-14(21)16-8-10-3-2-6-20-10/h2-7H,8H2,1H3,(H2,16,17,18,21)