2-chloranyl-N-[2,2,2-tris(chloranyl)-1-[(3-methylphenyl)carbamothioylamino]ethyl]benzamide

Systemtic Name: 2-chloranyl-N-[2,2,2-tris(chloranyl)-1-[(3-methylphenyl)carbamothioylamino]ethyl]benzamide Openeye Name: 2-chloro-N-[2,2,2-trichloro-1-(m-tolylcarbamothioylamino)ethyl]benzamide CAS Name: 2-chloro-N-[2,2,2-trichloro-1-[[(3-methylanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 2-chloro-N-[2,2,2-trichloro-1-[(3-methylphenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 2-chloro-N-[2,2,2-trichloro-1-(m-tolylthiocarbamoylamino)ethyl]benzamide Formula: C17H15Cl4N3OS MolecularWeight: 451.1975

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H15Cl4N3OS/c1-10-5-4-6-11(9-10)22-16(26)24-15(17(19,20)21)23-14(25)12-7-2-3-8-13(12)18/h2-9,15H,1H3,(H,23,25)(H2,22,24,26)