N-[2,2,2-tris(bromanyl)-1-[(4-methylphenyl)carbamothioylamino]ethyl]benzamide

Systemtic Name: N-[2,2,2-tris(bromanyl)-1-[(4-methylphenyl)carbamothioylamino]ethyl]benzamide Openeye Name: N-[2,2,2-tribromo-1-(p-tolylcarbamothioylamino)ethyl]benzamide CAS Name: N-[2,2,2-tribromo-1-[[(4-methylanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: N-[2,2,2-tribromo-1-[(4-methylphenyl)carbamothioylamino]ethyl]benzamide Traditional Name: N-[2,2,2-tribromo-1-(p-tolylthiocarbamoylamino)ethyl]benzamide Formula: C17H16Br3N3OS MolecularWeight: 550.10544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC(C(Br)(Br)Br)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC(C(Br)(Br)Br)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16Br3N3OS/c1-11-7-9-13(10-8-11)21-16(25)23-15(17(18,19)20)22-14(24)12-5-3-2-4-6-12/h2-10,15H,1H3,(H,22,24)(H2,21,23,25)