1-phenyl-3-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]urea

Systemtic Name: 1-phenyl-3-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]urea Openeye Name: 1-phenyl-3-[2,2,2-trichloro-1-(1-naphthylcarbamothioylamino)ethyl]urea CAS Name: 1-phenyl-3-[2,2,2-trichloro-1-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]urea IUPAC Name: 1-phenyl-3-[2,2,2-trichloro-1-(naphthalen-1-ylcarbamothioylamino)ethyl]urea Traditional Name: 1-phenyl-3-[2,2,2-trichloro-1-(1-naphthylthiocarbamoylamino)ethyl]urea Formula: C20H17Cl3N4OS MolecularWeight: 467.79918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17Cl3N4OS/c21-20(22,23)17(26-18(28)24-14-9-2-1-3-10-14)27-19(29)25-16-12-6-8-13-7-4-5-11-15(13)16/h1-12,17H,(H2,24,26,28)(H2,25,27,29)