N-[3-(azepan-1-yl)propyl]-2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[methylsulfonyl-(2-phenoxyphenyl)amino]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(N-methylsulfonyl-2-phenoxy-anilino)acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(N-mesyl-2-phenoxy-anilino)acetamide Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCCN1CCCCCC1)C2=CC=CC=C2OC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCCN1CCCCCC1)C2=CC=CC=C2OC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O4S/c1-32(29,30)27(20-24(28)25-16-11-19-26-17-9-2-3-10-18-26)22-14-7-8-15-23(22)31-21-12-5-4-6-13-21/h4-8,12-15H,2-3,9-11,16-20H2,1H3,(H,25,28)