N-[2,2,2-tris(chloranyl)-1-[[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]carbamothioylamino]ethyl]ethanamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-[[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]carbamothioylamino]ethyl]ethanamide Openeye Name: N-[2,2,2-trichloro-1-[[2-[(p-tolylsulfonylamino)carbamoyl]phenyl]carbamothioylamino]ethyl]acetamide CAS Name: N-[2,2,2-trichloro-1-[[[2-[[(4-methylphenyl)sulfonylhydrazo]-oxomethyl]anilino]-sulfanylidenemethyl]amino]ethyl]acetamide IUPAC Name: N-[2,2,2-trichloro-1-[[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]carbamothioylamino]ethyl]acetamide Traditional Name: N-[2,2,2-trichloro-1-[[2-[(tosylamino)carbamoyl]phenyl]thiocarbamoylamino]ethyl]acetamide Formula: C19H20Cl3N5O4S2 MolecularWeight: 552.8822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C2=CC=CC=C2NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C2=CC=CC=C2NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C

InChI

InChI=1S/C19H20Cl3N5O4S2/c1-11-7-9-13(10-8-11)33(30,31)27-26-16(29)14-5-3-4-6-15(14)24-18(32)25-17(19(20,21)22)23-12(2)28/h3-10,17,27H,1-2H3,(H,23,28)(H,26,29)(H2,24,25,32)