4-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-methyl-N-phenyl-benzamide

Systemtic Name: 4-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-methyl-N-phenyl-benzamide Openeye Name: 4-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-N-methyl-N-phenyl-benzamide CAS Name: 4-[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]amino]-N-methyl-N-phenylbenzamide IUPAC Name: 4-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-N-methyl-N-phenylbenzamide Traditional Name: 4-[4-(2,4-dichlorophenoxy)butanoylthiocarbamoylamino]-N-methyl-N-phenyl-benzamide Formula: C25H23Cl2N3O3S MolecularWeight: 516.43942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C25H23Cl2N3O3S/c1-30(20-6-3-2-4-7-20)24(32)17-9-12-19(13-10-17)28-25(34)29-23(31)8-5-15-33-22-14-11-18(26)16-21(22)27/h2-4,6-7,9-14,16H,5,8,15H2,1H3,(H2,28,29,31,34)