N-(4-fluorophenyl)-2-[4-(2-methylsulfonylethanoyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-(2-methylsulfonylethanoyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-(2-methylsulfonylacetyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-(2-methylsulfonyl-1-oxoethyl)-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-(2-methylsulfonylacetyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-(2-mesylacetyl)-1,4-diazepan-1-yl]acetamide Formula: C16H22FN3O4S MolecularWeight: 371.426983

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC(=O)N1CCCN(CC1)CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)CC(=O)N1CCCN(CC1)CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H22FN3O4S/c1-25(23,24)12-16(22)20-8-2-7-19(9-10-20)11-15(21)18-14-5-3-13(17)4-6-14/h3-6H,2,7-12H2,1H3,(H,18,21)