N-[1-[[2,4-bis(bromanyl)-5-methyl-phenyl]carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-4-bromanyl-benzamide

Systemtic Name: N-[1-[[2,4-bis(bromanyl)-5-methyl-phenyl]carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-4-bromanyl-benzamide Openeye Name: 4-bromo-N-[2,2,2-trichloro-1-[(2,4-dibromo-5-methyl-phenyl)carbamothioylamino]ethyl]benzamide CAS Name: 4-bromo-N-[2,2,2-trichloro-1-[[(2,4-dibromo-5-methylanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 4-bromo-N-[2,2,2-trichloro-1-[(2,4-dibromo-5-methylphenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 4-bromo-N-[2,2,2-trichloro-1-[(2,4-dibromo-5-methyl-phenyl)thiocarbamoylamino]ethyl]benzamide Formula: C17H13Br3Cl3N3OS MolecularWeight: 653.44062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)Br)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1Br)Br)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H13Br3Cl3N3OS/c1-8-6-13(12(20)7-11(8)19)24-16(28)26-15(17(21,22)23)25-14(27)9-2-4-10(18)5-3-9/h2-7,15H,1H3,(H,25,27)(H2,24,26,28)