2-[4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]butanoylamino]-N-cyclohexyl-benzamide

Systemtic Name: 2-[4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]butanoylamino]-N-cyclohexyl-benzamide Openeye Name: N-cyclohexyl-2-[4-(2,5-dichloro-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-cyclohexyl-2-[[4-(2,5-dichloro-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[4-(2,5-dichloro-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N-cyclohexyl-2-[4-(2,5-dichloro-N-mesyl-anilino)butanoylamino]benzamide Formula: C24H29Cl2N3O4S MolecularWeight: 526.47576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NC1=CC=CC=C1C(=O)NC2CCCCC2)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NC1=CC=CC=C1C(=O)NC2CCCCC2)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C24H29Cl2N3O4S/c1-34(32,33)29(22-16-17(25)13-14-20(22)26)15-7-12-23(30)28-21-11-6-5-10-19(21)24(31)27-18-8-3-2-4-9-18/h5-6,10-11,13-14,16,18H,2-4,7-9,12,15H2,1H3,(H,27,31)(H,28,30)