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

Systemtic Name: (3S,4S)-1-(4-methoxyphenyl)-3-(3-phenylpropyl)-4-(4-sulfanylphenyl)azetidin-2-one Openeye Name: (3S,4S)-1-(4-methoxyphenyl)-3-(3-phenylpropyl)-4-(4-sulfanylphenyl)azetidin-2-one CAS Name: (3S,4S)-4-(4-mercaptophenyl)-1-(4-methoxyphenyl)-3-(3-phenylpropyl)-2-azetidinone IUPAC Name: (3S,4S)-1-(4-methoxyphenyl)-3-(3-phenylpropyl)-4-(4-sulfanylphenyl)azetidin-2-one Traditional Name: (3S,4S)-4-(4-mercaptophenyl)-1-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-one Formula: C25H25NO2S MolecularWeight: 403.5365

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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)S

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO2S/c1-28-21-14-12-20(13-15-21)26-24(19-10-16-22(29)17-11-19)23(25(26)27)9-5-8-18-6-3-2-4-7-18/h2-4,6-7,10-17,23-24,29H,5,8-9H2,1H3/t23-,24+/m0/s1