N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(3-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(3-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(3-chloro-2-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(3-chloro-2-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(3-chloro-2-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(3-chloro-N-mesyl-2-methyl-anilino)acetamide Formula: C22H28ClN3O5S2 MolecularWeight: 514.05782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)N(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)C

InChI

InChI=1S/C22H28ClN3O5S2/c1-17-20(23)8-7-9-21(17)26(32(2,28)29)16-22(27)24-18-10-12-19(13-11-18)33(30,31)25-14-5-3-4-6-15-25/h7-13H,3-6,14-16H2,1-2H3,(H,24,27)