2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioyl-methyl-amino]-N-cyclohexyl-benzamide

Systemtic Name: 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioyl-methyl-amino]-N-cyclohexyl-benzamide Openeye Name: N-cyclohexyl-2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioyl-methyl-amino]benzamide CAS Name: N-cyclohexyl-2-[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]-methylamino]benzamide IUPAC Name: N-cyclohexyl-2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioyl-methylamino]benzamide Traditional Name: N-cyclohexyl-2-[4-(2,4-dichlorophenoxy)butanoylthiocarbamoyl-methyl-amino]benzamide Formula: C25H29Cl2N3O3S MolecularWeight: 522.48706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2CCCCC2)C(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C25H29Cl2N3O3S/c1-30(21-11-6-5-10-19(21)24(32)28-18-8-3-2-4-9-18)25(34)29-23(31)12-7-15-33-22-14-13-17(26)16-20(22)27/h5-6,10-11,13-14,16,18H,2-4,7-9,12,15H2,1H3,(H,28,32)(H,29,31,34)