N-[3-(azepan-1-yl)propyl]-2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(5-chloro-2-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(5-chloro-2-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(5-chloro-N-mesyl-2-methyl-anilino)acetamide Formula: C19H30ClN3O3S MolecularWeight: 415.9778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CC(=O)NCCCN2CCCCCC2)S(=O)(=O)C

InChI

InChI=1S/C19H30ClN3O3S/c1-16-8-9-17(20)14-18(16)23(27(2,25)26)15-19(24)21-10-7-13-22-11-5-3-4-6-12-22/h8-9,14H,3-7,10-13,15H2,1-2H3,(H,21,24)