N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-4-tert-butyl-benzamide

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-4-tert-butyl-benzamide Openeye Name: 4-tert-butyl-N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]benzamide Formula: C22H25Cl2N3O3S MolecularWeight: 482.4232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O3S/c1-22(2,3)15-8-6-14(7-9-15)20(29)25-21(31)27-26-19(28)5-4-12-30-18-11-10-16(23)13-17(18)24/h6-11,13H,4-5,12H2,1-3H3,(H,26,28)(H2,25,27,29,31)