N-[(1S)-2,2,2-tris(chloranyl)-1-isothiocyanato-ethyl]benzamide

Systemtic Name: N-[(1S)-2,2,2-tris(chloranyl)-1-isothiocyanato-ethyl]benzamide Openeye Name: N-[(1S)-2,2,2-trichloro-1-isothiocyanato-ethyl]benzamide CAS Name: N-[(1S)-2,2,2-trichloro-1-isothiocyanatoethyl]benzamide IUPAC Name: N-[(1S)-2,2,2-trichloro-1-isothiocyanatoethyl]benzamide Traditional Name: N-[(1S)-2,2,2-trichloro-1-isothiocyanato-ethyl]benzamide Formula: C10H7Cl3N2OS MolecularWeight: 309.59938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)N=C=S

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N[C@H](C(Cl)(Cl)Cl)N=C=S

InChI

InChI=1S/C10H7Cl3N2OS/c11-10(12,13)9(14-6-17)15-8(16)7-4-2-1-3-5-7/h1-5,9H,(H,15,16)/t9-/m1/s1