N-[4-(azepan-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)N2CCCCCC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)N2CCCCCC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O3S/c1-24(29(27,28)20-12-6-17(22)7-13-20)16-21(26)23-18-8-10-19(11-9-18)25-14-4-2-3-5-15-25/h6-13H,2-5,14-16H2,1H3,(H,23,26)