N-[3-(azepan-1-yl)propyl]-2-[(4-ethoxyphenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(4-ethoxyphenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(N-(4-ethoxyphenyl)sulfonylanilino)acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(N-(4-ethoxyphenyl)sulfonylanilino)acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(N-(4-ethoxyphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(N-p-phenetylsulfonylanilino)acetamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCN2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C25H35N3O4S/c1-2-32-23-13-15-24(16-14-23)33(30,31)28(22-11-6-5-7-12-22)21-25(29)26-17-10-20-27-18-8-3-4-9-19-27/h5-7,11-16H,2-4,8-10,17-21H2,1H3,(H,26,29)