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

Systemtic Name: 4-methyl-N-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]benzamide Openeye Name: 4-methyl-N-[2,2,2-trichloro-1-(1-naphthylcarbamothioylamino)ethyl]benzamide CAS Name: 4-methyl-N-[2,2,2-trichloro-1-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 4-methyl-N-[2,2,2-trichloro-1-(naphthalen-1-ylcarbamothioylamino)ethyl]benzamide Traditional Name: 4-methyl-N-[2,2,2-trichloro-1-(1-naphthylthiocarbamoylamino)ethyl]benzamide Formula: C21H18Cl3N3OS MolecularWeight: 466.81112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H18Cl3N3OS/c1-13-9-11-15(12-10-13)18(28)26-19(21(22,23)24)27-20(29)25-17-8-4-6-14-5-2-3-7-16(14)17/h2-12,19H,1H3,(H,26,28)(H2,25,27,29)