1,1-dimethyl-3-[2,2,2-tris(chloranyl)-1-[(4-iodophenyl)carbamothioylamino]ethyl]urea

Systemtic Name: 1,1-dimethyl-3-[2,2,2-tris(chloranyl)-1-[(4-iodophenyl)carbamothioylamino]ethyl]urea Openeye Name: 1,1-dimethyl-3-[2,2,2-trichloro-1-[(4-iodophenyl)carbamothioylamino]ethyl]urea CAS Name: 1,1-dimethyl-3-[2,2,2-trichloro-1-[[(4-iodoanilino)-sulfanylidenemethyl]amino]ethyl]urea IUPAC Name: 1,1-dimethyl-3-[2,2,2-trichloro-1-[(4-iodophenyl)carbamothioylamino]ethyl]urea Traditional Name: 1,1-dimethyl-3-[2,2,2-trichloro-1-[(4-iodophenyl)thiocarbamoylamino]ethyl]urea Formula: C12H14Cl3IN4OS MolecularWeight: 495.59423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=C(C=C1)I

Isomeric SMILES

CN(C)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=C(C=C1)I

InChI

InChI=1S/C12H14Cl3IN4OS/c1-20(2)11(21)19-9(12(13,14)15)18-10(22)17-8-5-3-7(16)4-6-8/h3-6,9H,1-2H3,(H,19,21)(H2,17,18,22)