(3S,4S)-3-[(4-tert-butylphenyl)sulfanylmethyl]-1-(4-methoxyphenyl)-4-phenyl-azetidin-2-one

Systemtic Name: (3S,4S)-3-[(4-tert-butylphenyl)sulfanylmethyl]-1-(4-methoxyphenyl)-4-phenyl-azetidin-2-one Openeye Name: (3S,4S)-3-[(4-tert-butylphenyl)sulfanylmethyl]-1-(4-methoxyphenyl)-4-phenyl-azetidin-2-one CAS Name: (3S,4S)-3-[[(4-tert-butylphenyl)thio]methyl]-1-(4-methoxyphenyl)-4-phenyl-2-azetidinone IUPAC Name: (3S,4S)-3-[(4-tert-butylphenyl)sulfanylmethyl]-1-(4-methoxyphenyl)-4-phenylazetidin-2-one Traditional Name: (3S,4S)-3-[[(4-tert-butylphenyl)thio]methyl]-1-(4-methoxyphenyl)-4-phenyl-azetidin-2-one Formula: C27H29NO2S MolecularWeight: 431.58966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC2C(N(C2=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC[C@H]2[C@H](N(C2=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO2S/c1-27(2,3)20-10-16-23(17-11-20)31-18-24-25(19-8-6-5-7-9-19)28(26(24)29)21-12-14-22(30-4)15-13-21/h5-17,24-25H,18H2,1-4H3/t24-,25+/m0/s1