2-[2-oxidanylidene-4-(phenylmethylsulfanyl)azetidin-1-yl]-N-(9-phenylnonyl)ethanamide

Systemtic Name: 2-[2-oxidanylidene-4-(phenylmethylsulfanyl)azetidin-1-yl]-N-(9-phenylnonyl)ethanamide Openeye Name: 2-(2-benzylsulfanyl-4-oxo-azetidin-1-yl)-N-(9-phenylnonyl)acetamide CAS Name: 2-[2-oxo-4-(phenylmethylthio)-1-azetidinyl]-N-(9-phenylnonyl)acetamide IUPAC Name: 2-(2-benzylsulfanyl-4-oxoazetidin-1-yl)-N-(9-phenylnonyl)acetamide Traditional Name: 2-[2-(benzylthio)-4-keto-azetidin-1-yl]-N-(9-phenylnonyl)acetamide Formula: C27H36N2O2S MolecularWeight: 452.65194

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C1=O)CC(=O)NCCCCCCCCCC2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

C1C(N(C1=O)CC(=O)NCCCCCCCCCC2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C27H36N2O2S/c30-25(21-29-26(31)20-27(29)32-22-24-17-11-7-12-18-24)28-19-13-5-3-1-2-4-8-14-23-15-9-6-10-16-23/h6-7,9-12,15-18,27H,1-5,8,13-14,19-22H2,(H,28,30)