N-[[2-(2,4-dimethylphenoxy)ethanoylamino]carbamothioyl]-2-iodanyl-benzamide

Systemtic Name: N-[[2-(2,4-dimethylphenoxy)ethanoylamino]carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-iodo-benzamide CAS Name: N-[[[2-(2,4-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-iodobenzamide Traditional Name: N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-2-iodo-benzamide Formula: C18H18IN3O3S MolecularWeight: 483.32329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2I)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CC=C2I)C

InChI

InChI=1S/C18H18IN3O3S/c1-11-7-8-15(12(2)9-11)25-10-16(23)21-22-18(26)20-17(24)13-5-3-4-6-14(13)19/h3-9H,10H2,1-2H3,(H,21,23)(H2,20,22,24,26)