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

Systemtic Name: 2-[4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide Openeye Name: 2-[4-(2,5-dichloro-N-methylsulfonyl-anilino)butanoylamino]-N-isopropyl-benzamide CAS Name: 2-[[4-(2,5-dichloro-N-methylsulfonylanilino)-1-oxobutyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-[4-(2,5-dichloro-N-methylsulfonylanilino)butanoylamino]-N-propan-2-ylbenzamide Traditional Name: 2-[4-(2,5-dichloro-N-mesyl-anilino)butanoylamino]-N-isopropyl-benzamide Formula: C21H25Cl2N3O4S MolecularWeight: 486.4119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H25Cl2N3O4S/c1-14(2)24-21(28)16-7-4-5-8-18(16)25-20(27)9-6-12-26(31(3,29)30)19-13-15(22)10-11-17(19)23/h4-5,7-8,10-11,13-14H,6,9,12H2,1-3H3,(H,24,28)(H,25,27)