N-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]prop-2-enamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]prop-2-enamide Openeye Name: N-[2,2,2-trichloro-1-(1-naphthylcarbamothioylamino)ethyl]prop-2-enamide CAS Name: N-[2,2,2-trichloro-1-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]-2-propenamide IUPAC Name: N-[2,2,2-trichloro-1-(naphthalen-1-ylcarbamothioylamino)ethyl]prop-2-enamide Traditional Name: N-[2,2,2-trichloro-1-(1-naphthylthiocarbamoylamino)ethyl]acrylamide Formula: C16H14Cl3N3OS MolecularWeight: 402.72586

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=CC2=CC=CC=C21

Isomeric SMILES

C=CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C16H14Cl3N3OS/c1-2-13(23)21-14(16(17,18)19)22-15(24)20-12-9-5-7-10-6-3-4-8-11(10)12/h2-9,14H,1H2,(H,21,23)(H2,20,22,24)