O-[(3S,4R)-1-(4-methoxyphenyl)-2-oxidanylidene-4-phenyl-azetidin-3-yl] methylsulfanylmethanethioate

Systemtic Name: O-[(3S,4R)-1-(4-methoxyphenyl)-2-oxidanylidene-4-phenyl-azetidin-3-yl] methylsulfanylmethanethioate Openeye Name: O-[(3S,4R)-1-(4-methoxyphenyl)-2-oxo-4-phenyl-azetidin-3-yl] methylsulfanylmethanethioate CAS Name: (methylthio)methanethioic acid O-[(3S,4R)-1-(4-methoxyphenyl)-2-oxo-4-phenyl-3-azetidinyl] ester IUPAC Name: O-[(3S,4R)-1-(4-methoxyphenyl)-2-oxo-4-phenylazetidin-3-yl] methylsulfanylmethanethioate Traditional Name: (methylthio)methanethioic acid O-[(3S,4R)-2-keto-1-(4-methoxyphenyl)-4-phenyl-azetidin-3-yl] ester Formula: C18H17NO3S2 MolecularWeight: 359.46248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C2=O)OC(=S)SC)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO3S2/c1-21-14-10-8-13(9-11-14)19-15(12-6-4-3-5-7-12)16(17(19)20)22-18(23)24-2/h3-11,15-16H,1-2H3/t15-,16+/m1/s1