1-[(1-methylpyrazol-4-yl)methyl]-3-oxidanyl-4-(triphenylmethyl)sulfanyl-azetidin-2-one

Systemtic Name: 1-[(1-methylpyrazol-4-yl)methyl]-3-oxidanyl-4-(triphenylmethyl)sulfanyl-azetidin-2-one Openeye Name: 3-hydroxy-1-[(1-methylpyrazol-4-yl)methyl]-4-tritylsulfanyl-azetidin-2-one CAS Name: 3-hydroxy-1-[(1-methyl-4-pyrazolyl)methyl]-4-[(triphenylmethyl)thio]-2-azetidinone IUPAC Name: 3-hydroxy-1-[(1-methylpyrazol-4-yl)methyl]-4-tritylsulfanylazetidin-2-one Traditional Name: 3-hydroxy-1-[(1-methylpyrazol-4-yl)methyl]-4-(tritylthio)azetidin-2-one Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2C(C(C2=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C=C(C=N1)CN2C(C(C2=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c1-29-18-20(17-28-29)19-30-25(32)24(31)26(30)33-27(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-18,24,26,31H,19H2,1H3