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

Systemtic Name: 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-phenethyl-benzamide Openeye Name: 2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-N-phenethyl-benzamide CAS Name: 2-[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-N-phenethylbenzamide Traditional Name: 2-[4-(2,4-dichlorophenoxy)butanoylthiocarbamoylamino]-N-phenethyl-benzamide Formula: C26H25Cl2N3O3S MolecularWeight: 530.466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C26H25Cl2N3O3S/c27-19-12-13-23(21(28)17-19)34-16-6-11-24(32)31-26(35)30-22-10-5-4-9-20(22)25(33)29-15-14-18-7-2-1-3-8-18/h1-5,7-10,12-13,17H,6,11,14-16H2,(H,29,33)(H2,30,31,32,35)