N-[2-[(4S,5E)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-2,2-dimethyl-1,3-dioxan-4-yl]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[(4S,5E)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-2,2-dimethyl-1,3-dioxan-4-yl]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[(4S,5E)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-2,2-dimethyl-1,3-dioxan-4-yl]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[(4S,5E)-5-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]imino]-2,2-dimethyl-1,3-dioxan-4-yl]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[(4S,5E)-5-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-2,2-dimethyl-1,3-dioxan-4-yl]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[(4S,5E)-5-[(2S)-2-(methoxymethyl)pyrrolidino]imino-2,2-dimethyl-1,3-dioxan-4-yl]ethyl]-4-methyl-benzenesulfonamide Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC2C(=NN3CCCC3COC)COC(O2)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[C@H]2/C(=N/N3CCC[C@H]3COC)/COC(O2)(C)C

InChI

InChI=1S/C21H33N3O5S/c1-16-7-9-18(10-8-16)30(25,26)22-12-11-20-19(15-28-21(2,3)29-20)23-24-13-5-6-17(24)14-27-4/h7-10,17,20,22H,5-6,11-15H2,1-4H3/b23-19+/t17-,20-/m0/s1