2,6-bis(chloranyl)-N-[4-[2-[2-(2,4-dimethylphenoxy)butanoylamino]phenyl]sulfanyl-5-oxidanylidene-1-[2,3,4,5,6-pentakis(chloranyl)phenyl]-4H-pyrazol-3-yl]benzamide

Systemtic Name: 2,6-bis(chloranyl)-N-[4-[2-[2-(2,4-dimethylphenoxy)butanoylamino]phenyl]sulfanyl-5-oxidanylidene-1-[2,3,4,5,6-pentakis(chloranyl)phenyl]-4H-pyrazol-3-yl]benzamide Openeye Name: 2,6-dichloro-N-[4-[2-[2-(2,4-dimethylphenoxy)butanoylamino]phenyl]sulfanyl-5-oxo-1-(2,3,4,5,6-pentachlorophenyl)-4H-pyrazol-3-yl]benzamide CAS Name: 2,6-dichloro-N-[4-[[2-[[2-(2,4-dimethylphenoxy)-1-oxobutyl]amino]phenyl]thio]-5-oxo-1-(2,3,4,5,6-pentachlorophenyl)-4H-pyrazol-3-yl]benzamide IUPAC Name: 2,6-dichloro-N-[4-[2-[2-(2,4-dimethylphenoxy)butanoylamino]phenyl]sulfanyl-5-oxo-1-(2,3,4,5,6-pentachlorophenyl)-4H-pyrazol-3-yl]benzamide Traditional Name: 2,6-dichloro-N-[4-[[2-[2-(2,4-dimethylphenoxy)butanoylamino]phenyl]thio]-5-keto-1-(2,3,4,5,6-pentachlorophenyl)-2-pyrazolin-3-yl]benzamide Formula: C34H25Cl7N4O4S MolecularWeight: 833.8227

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1SC2C(=NN(C2=O)C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)Cl)NC(=O)C4=C(C=CC=C4Cl)Cl)OC5=C(C=C(C=C5)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1SC2C(=NN(C2=O)C3=C(C(=C(C(=C3Cl)Cl)Cl)Cl)Cl)NC(=O)C4=C(C=CC=C4Cl)Cl)OC5=C(C=C(C=C5)C)C

InChI

InChI=1S/C34H25Cl7N4O4S/c1-4-20(49-21-13-12-15(2)14-16(21)3)32(46)42-19-10-5-6-11-22(19)50-30-31(43-33(47)23-17(35)8-7-9-18(23)36)44-45(34(30)48)29-27(40)25(38)24(37)26(39)28(29)41/h5-14,20,30H,4H2,1-3H3,(H,42,46)(H,43,44,47)