(2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-(phenylmethylsulfanyl)pent-4-en-1-imine

Systemtic Name: (2S)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-2-(phenylmethylsulfanyl)pent-4-en-1-imine Openeye Name: (2S)-2-benzylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]pent-4-en-1-imine CAS Name: (2S)-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-2-(phenylmethylthio)-4-penten-1-imine IUPAC Name: (2S)-2-benzylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]pent-4-en-1-imine Traditional Name: (E)-[(2S)-2-(benzylthio)pent-4-enylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1N=CC(CC=C)SCC2=CC=CC=C2

Isomeric SMILES

COC[C@@H]1CCCN1/N=C/[C@H](CC=C)SCC2=CC=CC=C2

InChI

InChI=1S/C18H26N2OS/c1-3-8-18(22-15-16-9-5-4-6-10-16)13-19-20-12-7-11-17(20)14-21-2/h3-6,9-10,13,17-18H,1,7-8,11-12,14-15H2,2H3/b19-13+/t17-,18-/m0/s1