N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S)-1-(azepane-1-carbonyl)-2-methyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-1-(1-azepanyl)-3-methyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S)-1-(azepane-1-carbonyl)-2-methyl-propyl]-4-methyl-benzenesulfonamide Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)N2CCCCCC2

InChI

InChI=1S/C18H28N2O3S/c1-14(2)17(18(21)20-12-6-4-5-7-13-20)19-24(22,23)16-10-8-15(3)9-11-16/h8-11,14,17,19H,4-7,12-13H2,1-3H3/t17-/m0/s1