3-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-tert-butyl-benzamide

Systemtic Name: 3-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-tert-butyl-benzamide Openeye Name: N-tert-butyl-3-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]benzamide CAS Name: N-tert-butyl-3-[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-3-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]benzamide Traditional Name: N-tert-butyl-3-[4-(2,4-dichlorophenoxy)butanoylthiocarbamoylamino]benzamide Formula: C22H25Cl2N3O3S MolecularWeight: 482.4232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25Cl2N3O3S/c1-22(2,3)27-20(29)14-6-4-7-16(12-14)25-21(31)26-19(28)8-5-11-30-18-10-9-15(23)13-17(18)24/h4,6-7,9-10,12-13H,5,8,11H2,1-3H3,(H,27,29)(H2,25,26,28,31)