N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-phenoxy-acetamide Formula: C18H17Br2N3O4S MolecularWeight: 531.21828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NNC(=S)NC(=O)COC2=CC=CC=C2)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NNC(=S)NC(=O)COC2=CC=CC=C2)Br)Br

InChI

InChI=1S/C18H17Br2N3O4S/c1-11-7-12(19)8-14(20)17(11)27-10-16(25)22-23-18(28)21-15(24)9-26-13-5-3-2-4-6-13/h2-8H,9-10H2,1H3,(H,22,25)(H2,21,23,24,28)