3,4,5-trimethoxy-N-[2,2,2-tris(chloranyl)-1-[[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]carbamothioylamino]ethyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[2,2,2-tris(chloranyl)-1-[[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]carbamothioylamino]ethyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[[2-[(p-tolylsulfonylamino)carbamoyl]phenyl]carbamothioylamino]ethyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[[[2-[[(4-methylphenyl)sulfonylhydrazo]-oxomethyl]anilino]-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]carbamothioylamino]ethyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[2,2,2-trichloro-1-[[2-[(tosylamino)carbamoyl]phenyl]thiocarbamoylamino]ethyl]benzamide Formula: C27H28Cl3N5O7S2 MolecularWeight: 705.02952

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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)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C2=CC=CC=C2NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C27H28Cl3N5O7S2/c1-15-9-11-17(12-10-15)44(38,39)35-34-24(37)18-7-5-6-8-19(18)31-26(43)33-25(27(28,29)30)32-23(36)16-13-20(40-2)22(42-4)21(14-16)41-3/h5-14,25,35H,1-4H3,(H,32,36)(H,34,37)(H2,31,33,43)