N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]-3-chloranyl-benzamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]-3-chloranyl-benzamide Openeye Name: 3-chloro-N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-chloro-N-[[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-N-[[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-chloro-N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C17H14Br2ClN3O3S MolecularWeight: 535.63736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14Br2ClN3O3S/c1-9-5-11(18)7-13(19)15(9)26-8-14(24)22-23-17(27)21-16(25)10-3-2-4-12(20)6-10/h2-7H,8H2,1H3,(H,22,24)(H2,21,23,25,27)