4-methyl-N-[2,2,2-tris(chloranyl)-1-(phenylcarbamothioylamino)ethyl]benzamide

Systemtic Name: 4-methyl-N-[2,2,2-tris(chloranyl)-1-(phenylcarbamothioylamino)ethyl]benzamide Openeye Name: 4-methyl-N-[2,2,2-trichloro-1-(phenylcarbamothioylamino)ethyl]benzamide CAS Name: N-[1-[[anilino(sulfanylidene)methyl]amino]-2,2,2-trichloroethyl]-4-methylbenzamide IUPAC Name: 4-methyl-N-[2,2,2-trichloro-1-(phenylcarbamothioylamino)ethyl]benzamide Traditional Name: 4-methyl-N-[2,2,2-trichloro-1-(phenylthiocarbamoylamino)ethyl]benzamide Formula: C17H16Cl3N3OS MolecularWeight: 416.75244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C17H16Cl3N3OS/c1-11-7-9-12(10-8-11)14(24)22-15(17(18,19)20)23-16(25)21-13-5-3-2-4-6-13/h2-10,15H,1H3,(H,22,24)(H2,21,23,25)