N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(5-chloro-2-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(5-chloro-2-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(5-chloro-N-mesyl-2-methyl-anilino)butyramide Formula: C24H32ClN3O5S2 MolecularWeight: 542.11098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C24H32ClN3O5S2/c1-19-9-10-20(25)18-23(19)28(34(2,30)31)17-7-8-24(29)26-21-11-13-22(14-12-21)35(32,33)27-15-5-3-4-6-16-27/h9-14,18H,3-8,15-17H2,1-2H3,(H,26,29)