N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-tris(chloranyl)ethyl]-2-phenyl-ethanamide Openeye Name: N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-trichloro-ethyl]-2-phenyl-acetamide CAS Name: N-[1-[[(3-bromoanilino)-sulfanylidenemethyl]amino]-2,2,2-trichloroethyl]-2-phenylacetamide IUPAC Name: N-[1-[(3-bromophenyl)carbamothioylamino]-2,2,2-trichloroethyl]-2-phenylacetamide Traditional Name: N-[1-[(3-bromophenyl)thiocarbamoylamino]-2,2,2-trichloro-ethyl]-2-phenyl-acetamide Formula: C17H15BrCl3N3OS MolecularWeight: 495.6485

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H15BrCl3N3OS/c18-12-7-4-8-13(10-12)22-16(26)24-15(17(19,20)21)23-14(25)9-11-5-2-1-3-6-11/h1-8,10,15H,9H2,(H,23,25)(H2,22,24,26)