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

Systemtic Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methyl-ethanamide Openeye Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methyl-acetamide CAS Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methylacetamide IUPAC Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]-N-methylacetamide Traditional Name: N-[2-(4-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=C(C=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C21H26FN3O3S/c1-16(26)24(3)20-15-18(25-12-4-11-23(2)13-14-25)7-10-21(20)29(27,28)19-8-5-17(22)6-9-19/h5-10,15H,4,11-14H2,1-3H3