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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]propanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)propanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloro-2-methyl-N-methylsulfonylanilino)propanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(5-chloro-N-mesyl-2-methyl-anilino)propionamide Formula: C23H30ClN3O5S2 MolecularWeight: 528.0844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30ClN3O5S2/c1-17-8-9-19(24)16-22(17)27(33(3,29)30)18(2)23(28)25-20-10-12-21(13-11-20)34(31,32)26-14-6-4-5-7-15-26/h8-13,16,18H,4-7,14-15H2,1-3H3,(H,25,28)