N-[(1S)-2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]propanamide

Systemtic Name: N-[(1S)-2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]propanamide Openeye Name: N-[(1S)-2,2,2-trichloro-1-(1-naphthylcarbamothioylamino)ethyl]propanamide CAS Name: N-[(1S)-2,2,2-trichloro-1-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]propanamide IUPAC Name: N-[(1S)-2,2,2-trichloro-1-(naphthalen-1-ylcarbamothioylamino)ethyl]propanamide Traditional Name: N-[(1S)-2,2,2-trichloro-1-(1-naphthylthiocarbamoylamino)ethyl]propionamide Formula: C16H16Cl3N3OS MolecularWeight: 404.74174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)N[C@H](C(Cl)(Cl)Cl)NC(=S)NC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C16H16Cl3N3OS/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/h3-9,14H,2H2,1H3,(H,21,23)(H2,20,22,24)/t14-/m0/s1