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

Systemtic Name: [1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-oxidanylidene-4-(triphenylmethyl)sulfanyl-azetidin-3-yl] ethanoate Openeye Name: [1-[(2-methyloxazol-4-yl)methyl]-2-oxo-4-tritylsulfanyl-azetidin-3-yl] acetate CAS Name: acetic acid [1-[(2-methyl-4-oxazolyl)methyl]-2-oxo-4-[(triphenylmethyl)thio]-3-azetidinyl] ester IUPAC Name: [1-[(2-methyl-1,3-oxazol-4-yl)methyl]-2-oxo-4-tritylsulfanylazetidin-3-yl] acetate Traditional Name: acetic acid [2-keto-1-[(2-methyloxazol-4-yl)methyl]-4-(tritylthio)azetidin-3-yl] ester Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CO1)CN2C(C(C2=O)OC(=O)C)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=CO1)CN2C(C(C2=O)OC(=O)C)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O4S/c1-20-30-25(19-34-20)18-31-27(33)26(35-21(2)32)28(31)36-29(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-17,19,26,28H,18H2,1-2H3