N-[1-[(4-bromophenyl)carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-4-chloranyl-benzamide

Systemtic Name: N-[1-[(4-bromophenyl)carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-4-chloranyl-benzamide Openeye Name: N-[1-[(4-bromophenyl)carbamothioylamino]-2,2,2-trichloro-ethyl]-4-chloro-benzamide CAS Name: N-[1-[[(4-bromoanilino)-sulfanylidenemethyl]amino]-2,2,2-trichloroethyl]-4-chlorobenzamide IUPAC Name: N-[1-[(4-bromophenyl)carbamothioylamino]-2,2,2-trichloroethyl]-4-chlorobenzamide Traditional Name: N-[1-[(4-bromophenyl)thiocarbamoylamino]-2,2,2-trichloro-ethyl]-4-chloro-benzamide Formula: C16H12BrCl4N3OS MolecularWeight: 516.06698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)Br)Cl

InChI

InChI=1S/C16H12BrCl4N3OS/c17-10-3-7-12(8-4-10)22-15(26)24-14(16(19,20)21)23-13(25)9-1-5-11(18)6-2-9/h1-8,14H,(H,23,25)(H2,22,24,26)