3-iodanyl-N-[2,2,2-tris(chloranyl)-1-[[4-(triphenylmethyl)phenyl]carbamothioylamino]ethyl]benzamide

Systemtic Name: 3-iodanyl-N-[2,2,2-tris(chloranyl)-1-[[4-(triphenylmethyl)phenyl]carbamothioylamino]ethyl]benzamide Openeye Name: 3-iodo-N-[2,2,2-trichloro-1-[(4-tritylphenyl)carbamothioylamino]ethyl]benzamide CAS Name: 3-iodo-N-[2,2,2-trichloro-1-[[sulfanylidene-[4-(triphenylmethyl)anilino]methyl]amino]ethyl]benzamide IUPAC Name: 3-iodo-N-[2,2,2-trichloro-1-[(4-tritylphenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 3-iodo-N-[2,2,2-trichloro-1-[(4-tritylphenyl)thiocarbamoylamino]ethyl]benzamide Formula: C35H27Cl3IN3OS MolecularWeight: 770.93685

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C5=CC(=CC=C5)I

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C5=CC(=CC=C5)I

InChI

InChI=1S/C35H27Cl3IN3OS/c36-35(37,38)32(41-31(43)24-11-10-18-29(39)23-24)42-33(44)40-30-21-19-28(20-22-30)34(25-12-4-1-5-13-25,26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-23,32H,(H,41,43)(H2,40,42,44)