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

Systemtic Name: 3-methoxy-N-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]benzamide Openeye Name: 3-methoxy-N-[2,2,2-trichloro-1-(1-naphthylcarbamothioylamino)ethyl]benzamide CAS Name: 3-methoxy-N-[2,2,2-trichloro-1-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 3-methoxy-N-[2,2,2-trichloro-1-(naphthalen-1-ylcarbamothioylamino)ethyl]benzamide Traditional Name: 3-methoxy-N-[2,2,2-trichloro-1-(1-naphthylthiocarbamoylamino)ethyl]benzamide Formula: C21H18Cl3N3O2S MolecularWeight: 482.81052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H18Cl3N3O2S/c1-29-15-9-4-8-14(12-15)18(28)26-19(21(22,23)24)27-20(30)25-17-11-5-7-13-6-2-3-10-16(13)17/h2-12,19H,1H3,(H,26,28)(H2,25,27,30)