N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methyl-ethanamide

Systemtic Name: N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methyl-ethanamide Openeye Name: N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methyl-acetamide CAS Name: N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methylacetamide IUPAC Name: N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methylacetamide Traditional Name: N-[2-(3-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methyl-acetamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC(=O)N(C)C1=C(C=CC(=C1)N2CCCN(CC2)C)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C21H26FN3O3S/c1-16(26)24(3)20-15-18(25-11-5-10-23(2)12-13-25)8-9-21(20)29(27,28)19-7-4-6-17(22)14-19/h4,6-9,14-15H,5,10-13H2,1-3H3