3-iodanyl-4-methyl-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methyl-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]benzamide Openeye Name: 3-iodo-4-methyl-N-[[2-(2-naphthyloxy)propanoylamino]carbamothioyl]benzamide CAS Name: 3-iodo-4-methyl-N-[[[2-(2-naphthalenyloxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methyl-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]benzamide Traditional Name: 3-iodo-4-methyl-N-[[2-(2-naphthoxy)propanoylamino]thiocarbamoyl]benzamide Formula: C22H20IN3O3S MolecularWeight: 533.38197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC3=CC=CC=C3C=C2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC3=CC=CC=C3C=C2)I

InChI

InChI=1S/C22H20IN3O3S/c1-13-7-8-17(12-19(13)23)21(28)24-22(30)26-25-20(27)14(2)29-18-10-9-15-5-3-4-6-16(15)11-18/h3-12,14H,1-2H3,(H,25,27)(H2,24,26,28,30)