(3R,4S)-1-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-3-(3-phenylpropyl)azetidin-2-one

Systemtic Name: (3R,4S)-1-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-3-(3-phenylpropyl)azetidin-2-one Openeye Name: (3R,4S)-1-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-3-(3-phenylpropyl)azetidin-2-one CAS Name: (3R,4S)-1-(4-methoxyphenyl)-4-[4-(methylthio)phenyl]-3-(3-phenylpropyl)-2-azetidinone IUPAC Name: (3R,4S)-1-(4-methoxyphenyl)-4-(4-methylsulfanylphenyl)-3-(3-phenylpropyl)azetidin-2-one Traditional Name: (3R,4S)-1-(4-methoxyphenyl)-4-[4-(methylthio)phenyl]-3-(3-phenylpropyl)azetidin-2-one Formula: C26H27NO2S MolecularWeight: 417.56308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C2=O)CCCC3=CC=CC=C3)C4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@@H]([C@H](C2=O)CCCC3=CC=CC=C3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C26H27NO2S/c1-29-22-15-13-21(14-16-22)27-25(20-11-17-23(30-2)18-12-20)24(26(27)28)10-6-9-19-7-4-3-5-8-19/h3-5,7-8,11-18,24-25H,6,9-10H2,1-2H3/t24-,25-/m1/s1