3-iodanyl-4-methoxy-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[[2-(2-methylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 3-iodo-4-methoxy-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-iodo-4-methoxy-N-[[[2-(2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-[[[2-(2-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-iodo-4-methoxy-N-[[[2-(2-methylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C18H18IN3O4S MolecularWeight: 499.32269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OC)I

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OC)I

InChI

InChI=1S/C18H18IN3O4S/c1-11-5-3-4-6-14(11)26-10-16(23)21-22-18(27)20-17(24)12-7-8-15(25-2)13(19)9-12/h3-9H,10H2,1-2H3,(H,21,23)(H2,20,22,24,27)