3-bromanyl-N-[2,2,2-tris(chloranyl)-1-(naphthalen-2-ylcarbamothioylamino)ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2,2,2-tris(chloranyl)-1-(naphthalen-2-ylcarbamothioylamino)ethyl]benzamide Openeye Name: 3-bromo-N-[2,2,2-trichloro-1-(2-naphthylcarbamothioylamino)ethyl]benzamide CAS Name: 3-bromo-N-[2,2,2-trichloro-1-[[(2-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 3-bromo-N-[2,2,2-trichloro-1-(naphthalen-2-ylcarbamothioylamino)ethyl]benzamide Traditional Name: 3-bromo-N-[2,2,2-trichloro-1-(2-naphthylthiocarbamoylamino)ethyl]benzamide Formula: C20H15BrCl3N3OS MolecularWeight: 531.6806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H15BrCl3N3OS/c21-15-7-3-6-14(10-15)17(28)26-18(20(22,23)24)27-19(29)25-16-9-8-12-4-1-2-5-13(12)11-16/h1-11,18H,(H,26,28)(H2,25,27,29)