[4-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]-phenyl-methanone

Systemtic Name: [4-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]-phenyl-methanone Openeye Name: [4-(2-fluoro-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]-phenyl-methanone CAS Name: [4-(2-fluoro-4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-phenylmethanone IUPAC Name: [4-(2-fluoro-4-methylsulfonylphenyl)-1,4-diazepan-1-yl]-phenylmethanone Traditional Name: [4-(2-fluoro-4-mesyl-phenyl)-1,4-diazepan-1-yl]-phenyl-methanone Formula: C19H21FN2O3S MolecularWeight: 376.445043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCCN(CC2)C(=O)C3=CC=CC=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCCN(CC2)C(=O)C3=CC=CC=C3)F

InChI

InChI=1S/C19H21FN2O3S/c1-26(24,25)16-8-9-18(17(20)14-16)21-10-5-11-22(13-12-21)19(23)15-6-3-2-4-7-15/h2-4,6-9,14H,5,10-13H2,1H3