(2S)-3-(4-bromophenyl)-2-tert-butylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]propan-1-imine

Systemtic Name: (2S)-3-(4-bromophenyl)-2-tert-butylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]propan-1-imine Openeye Name: (2S)-3-(4-bromophenyl)-2-tert-butylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]propan-1-imine CAS Name: (2S)-3-(4-bromophenyl)-2-(tert-butylthio)-N-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]-1-propanimine IUPAC Name: (2S)-3-(4-bromophenyl)-2-tert-butylsulfanyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]propan-1-imine Traditional Name: (E)-[(2S)-3-(4-bromophenyl)-2-(tert-butylthio)propylidene]-[(2S)-2-(methoxymethyl)pyrrolidino]amine Formula: C19H29BrN2OS MolecularWeight: 413.41536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(CC1=CC=C(C=C1)Br)C=NN2CCCC2COC

Isomeric SMILES

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

InChI

InChI=1S/C19H29BrN2OS/c1-19(2,3)24-18(12-15-7-9-16(20)10-8-15)13-21-22-11-5-6-17(22)14-23-4/h7-10,13,17-18H,5-6,11-12,14H2,1-4H3/b21-13+/t17-,18-/m0/s1