(2S,3R,4R)-2-ethyl-1-(4-methoxyphenyl)-4-methyl-3-phenylsulfanyl-pyrrolidine

Systemtic Name: (2S,3R,4R)-2-ethyl-1-(4-methoxyphenyl)-4-methyl-3-phenylsulfanyl-pyrrolidine Openeye Name: (2S,3R,4R)-2-ethyl-1-(4-methoxyphenyl)-4-methyl-3-phenylsulfanyl-pyrrolidine CAS Name: (2S,3R,4R)-2-ethyl-1-(4-methoxyphenyl)-4-methyl-3-(phenylthio)pyrrolidine IUPAC Name: (2S,3R,4R)-2-ethyl-1-(4-methoxyphenyl)-4-methyl-3-phenylsulfanylpyrrolidine Traditional Name: (2S,3R,4R)-2-ethyl-1-(4-methoxyphenyl)-4-methyl-3-(phenylthio)pyrrolidine Formula: C20H25NOS MolecularWeight: 327.4836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(CN1C2=CC=C(C=C2)OC)C)SC3=CC=CC=C3

Isomeric SMILES

CC[C@H]1[C@@H]([C@@H](CN1C2=CC=C(C=C2)OC)C)SC3=CC=CC=C3

InChI

InChI=1S/C20H25NOS/c1-4-19-20(23-18-8-6-5-7-9-18)15(2)14-21(19)16-10-12-17(22-3)13-11-16/h5-13,15,19-20H,4,14H2,1-3H3/t15-,19+,20-/m1/s1