(2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-4-methyl-2-(phenylmethylsulfanyl)pentan-1-imine

Systemtic Name: (2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-4-methyl-2-(phenylmethylsulfanyl)pentan-1-imine Openeye Name: (2S)-2-benzylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-4-methyl-pentan-1-imine CAS Name: (2S)-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-4-methyl-2-(phenylmethylthio)-1-pentanimine IUPAC Name: (2S)-2-benzylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-4-methylpentan-1-imine Traditional Name: (E)-[(2S)-2-(benzylthio)-4-methyl-pentylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine Formula: C19H30N2OS MolecularWeight: 334.5193

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2OS/c1-16(2)12-19(23-15-17-8-5-4-6-9-17)13-20-21-11-7-10-18(21)14-22-3/h4-6,8-9,13,16,18-19H,7,10-12,14-15H2,1-3H3/b20-13+/t18-,19-/m0/s1