(2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-3-methyl-2-(phenylmethylsulfanyl)butan-1-imine

Systemtic Name: (2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-3-methyl-2-(phenylmethylsulfanyl)butan-1-imine Openeye Name: (2S)-2-benzylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-3-methyl-butan-1-imine CAS Name: (2S)-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-3-methyl-2-(phenylmethylthio)-1-butanimine IUPAC Name: (2S)-2-benzylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-3-methylbutan-1-imine Traditional Name: (E)-[(2S)-2-(benzylthio)-3-methyl-butylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine Formula: C18H28N2OS MolecularWeight: 320.49272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=NN1CCCC1COC)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](/C=N/N1CCC[C@H]1COC)SCC2=CC=CC=C2

InChI

InChI=1S/C18H28N2OS/c1-15(2)18(22-14-16-8-5-4-6-9-16)12-19-20-11-7-10-17(20)13-21-3/h4-6,8-9,12,15,17-18H,7,10-11,13-14H2,1-3H3/b19-12+/t17-,18+/m0/s1