N-[1-[[2,6-bis(chloranyl)phenyl]carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-2-chloranyl-benzamide

Systemtic Name: N-[1-[[2,6-bis(chloranyl)phenyl]carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-2-chloranyl-benzamide Openeye Name: 2-chloro-N-[2,2,2-trichloro-1-[(2,6-dichlorophenyl)carbamothioylamino]ethyl]benzamide CAS Name: 2-chloro-N-[2,2,2-trichloro-1-[[(2,6-dichloroanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 2-chloro-N-[2,2,2-trichloro-1-[(2,6-dichlorophenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 2-chloro-N-[2,2,2-trichloro-1-[(2,6-dichlorophenyl)thiocarbamoylamino]ethyl]benzamide Formula: C16H11Cl6N3OS MolecularWeight: 506.06104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=C(C=CC=C2Cl)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=C(C=CC=C2Cl)Cl)Cl

InChI

InChI=1S/C16H11Cl6N3OS/c17-9-5-2-1-4-8(9)13(26)24-14(16(20,21)22)25-15(27)23-12-10(18)6-3-7-11(12)19/h1-7,14H,(H,24,26)(H2,23,25,27)