S-phenyl 2-[1-(2-methoxyphenyl)-2-oxidanylidene-4-(1-phenylmethoxyethyl)azetidin-3-yl]ethanethioate

Systemtic Name: S-phenyl 2-[1-(2-methoxyphenyl)-2-oxidanylidene-4-(1-phenylmethoxyethyl)azetidin-3-yl]ethanethioate Openeye Name: S-phenyl 2-[2-(1-benzyloxyethyl)-1-(2-methoxyphenyl)-4-oxo-azetidin-3-yl]ethanethioate CAS Name: 2-[1-(2-methoxyphenyl)-2-oxo-4-(1-phenylmethoxyethyl)-3-azetidinyl]ethanethioic acid S-phenyl ester IUPAC Name: S-phenyl 2-[1-(2-methoxyphenyl)-2-oxo-4-(1-phenylmethoxyethyl)azetidin-3-yl]ethanethioate Traditional Name: 2-[2-(1-benzoxyethyl)-4-keto-1-(2-methoxyphenyl)azetidin-3-yl]ethanethioic acid S-phenyl ester Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(C(=O)N1C2=CC=CC=C2OC)CC(=O)SC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C1C(C(=O)N1C2=CC=CC=C2OC)CC(=O)SC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27NO4S/c1-19(32-18-20-11-5-3-6-12-20)26-22(17-25(29)33-21-13-7-4-8-14-21)27(30)28(26)23-15-9-10-16-24(23)31-2/h3-16,19,22,26H,17-18H2,1-2H3