5-fluoranyl-2-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 5-fluoranyl-2-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Openeye Name: 5-fluoro-N-[(4-isopropoxyphenyl)methyl]-2-methyl-N-[(3S)-2-oxoazepan-3-yl]benzenesulfonamide CAS Name: 5-fluoro-2-methyl-N-[(3S)-2-oxo-3-azepanyl]-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide IUPAC Name: 5-fluoro-2-methyl-N-[(3S)-2-oxoazepan-3-yl]-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Traditional Name: 5-fluoro-N-(4-isopropoxybenzyl)-N-[(3S)-2-ketoazepan-3-yl]-2-methyl-benzenesulfonamide Formula: C23H29FN2O4S MolecularWeight: 448.550763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)N(CC2=CC=C(C=C2)OC(C)C)C3CCCCNC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N(CC2=CC=C(C=C2)OC(C)C)[C@H]3CCCCNC3=O

InChI

InChI=1S/C23H29FN2O4S/c1-16(2)30-20-11-8-18(9-12-20)15-26(21-6-4-5-13-25-23(21)27)31(28,29)22-14-19(24)10-7-17(22)3/h7-12,14,16,21H,4-6,13,15H2,1-3H3,(H,25,27)/t21-/m0/s1