3-[[1-(diphenylmethyl)azetidin-3-ylidene]-methylsulfonyl-methyl]benzenecarbonitrile

Systemtic Name: 3-[[1-(diphenylmethyl)azetidin-3-ylidene]-methylsulfonyl-methyl]benzenecarbonitrile Openeye Name: 3-[(1-benzhydrylazetidin-3-ylidene)-methylsulfonyl-methyl]benzonitrile CAS Name: 3-[[1-(diphenylmethyl)-3-azetidinylidene]-methylsulfonylmethyl]benzonitrile IUPAC Name: 3-[(1-benzhydrylazetidin-3-ylidene)-methylsulfonylmethyl]benzonitrile Traditional Name: 3-[(1-benzhydrylazetidin-3-ylidene)-mesyl-methyl]benzonitrile Formula: C25H22N2O2S MolecularWeight: 414.51938

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(=C1CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

CS(=O)(=O)C(=C1CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H22N2O2S/c1-30(28,29)25(22-14-8-9-19(15-22)16-26)23-17-27(18-23)24(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-15,24H,17-18H2,1H3