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

Systemtic Name: N-[1-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-4-chloranyl-benzamide Openeye Name: 4-chloro-N-[2,2,2-trichloro-1-[(2,5-dichlorophenyl)carbamothioylamino]ethyl]benzamide CAS Name: 4-chloro-N-[2,2,2-trichloro-1-[[(2,5-dichloroanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 4-chloro-N-[2,2,2-trichloro-1-[(2,5-dichlorophenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 4-chloro-N-[2,2,2-trichloro-1-[(2,5-dichlorophenyl)thiocarbamoylamino]ethyl]benzamide Formula: C16H11Cl6N3OS MolecularWeight: 506.06104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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