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

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(2-methoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(2-methoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(2-methoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(N-mesyl-2-methoxy-anilino)acetamide Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C

InChI

InChI=1S/C19H31N3O4S/c1-26-18-11-6-5-10-17(18)22(27(2,24)25)16-19(23)20-12-9-15-21-13-7-3-4-8-14-21/h5-6,10-11H,3-4,7-9,12-16H2,1-2H3,(H,20,23)