2-[3-bromanyl-2-oxidanylidene-4-(phenylmethyl)sulfinyl-azetidin-1-yl]-N-(6-phenylhexyl)ethanamide

Systemtic Name: 2-[3-bromanyl-2-oxidanylidene-4-(phenylmethyl)sulfinyl-azetidin-1-yl]-N-(6-phenylhexyl)ethanamide Openeye Name: 2-(2-benzylsulfinyl-3-bromo-4-oxo-azetidin-1-yl)-N-(6-phenylhexyl)acetamide CAS Name: 2-[3-bromo-2-oxo-4-(phenylmethyl)sulfinyl-1-azetidinyl]-N-(6-phenylhexyl)acetamide IUPAC Name: 2-(2-benzylsulfinyl-3-bromo-4-oxoazetidin-1-yl)-N-(6-phenylhexyl)acetamide Traditional Name: 2-(2-benzylsulfinyl-3-bromo-4-keto-azetidin-1-yl)-N-(6-phenylhexyl)acetamide Formula: C24H29BrN2O3S MolecularWeight: 505.46766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCNC(=O)CN2C(C(C2=O)Br)S(=O)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCNC(=O)CN2C(C(C2=O)Br)S(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H29BrN2O3S/c25-22-23(29)27(24(22)31(30)18-20-14-8-4-9-15-20)17-21(28)26-16-10-2-1-5-11-19-12-6-3-7-13-19/h3-4,6-9,12-15,22,24H,1-2,5,10-11,16-18H2,(H,26,28)