N-[(3S,4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3-methyl-butyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(3S,4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3-methyl-butyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(3S,4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3-methyl-butyl]-4-methyl-benzenesulfonamide CAS Name: N-[(3S,4E)-4-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]imino]-3-methylbutyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(3S,4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imino-3-methylbutyl]-4-methylbenzenesulfonamide Traditional Name: N-[(3S,4E)-4-[(2S)-2-(methoxymethyl)pyrrolidino]imino-3-methyl-butyl]-4-methyl-benzenesulfonamide Formula: C18H29N3O3S MolecularWeight: 367.50616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(C)C=NN2CCCC2COC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[C@H](C)/C=N/N2CCC[C@H]2COC

InChI

InChI=1S/C18H29N3O3S/c1-15-6-8-18(9-7-15)25(22,23)20-11-10-16(2)13-19-21-12-4-5-17(21)14-24-3/h6-9,13,16-17,20H,4-5,10-12,14H2,1-3H3/b19-13+/t16-,17-/m0/s1