[(5-methyl-1,2,4-oxadiazol-3-yl)-[2-oxidanylidene-4-(triphenylmethyl)sulfanyl-azetidin-3-yl]methyl] ethanoate

Systemtic Name: [(5-methyl-1,2,4-oxadiazol-3-yl)-[2-oxidanylidene-4-(triphenylmethyl)sulfanyl-azetidin-3-yl]methyl] ethanoate Openeye Name: [(5-methyl-1,2,4-oxadiazol-3-yl)-(2-oxo-4-tritylsulfanyl-azetidin-3-yl)methyl] acetate CAS Name: acetic acid [(5-methyl-1,2,4-oxadiazol-3-yl)-[2-oxo-4-[(triphenylmethyl)thio]-3-azetidinyl]methyl] ester IUPAC Name: [(5-methyl-1,2,4-oxadiazol-3-yl)-(2-oxo-4-tritylsulfanylazetidin-3-yl)methyl] acetate Traditional Name: acetic acid [[2-keto-4-(tritylthio)azetidin-3-yl]-(5-methyl-1,2,4-oxadiazol-3-yl)methyl] ester Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NO1)C(C2C(NC2=O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OC(=O)C

Isomeric SMILES

CC1=NC(=NO1)C(C2C(NC2=O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OC(=O)C

InChI

InChI=1S/C28H25N3O4S/c1-18-29-25(31-35-18)24(34-19(2)32)23-26(33)30-27(23)36-28(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17,23-24,27H,1-2H3,(H,30,33)