3-[[4-(1,3-dithian-2-yl)phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(1,3-dithian-2-yl)phenoxy]methyl]benzenecarbonitrile Openeye Name: 3-[[4-(1,3-dithian-2-yl)phenoxy]methyl]benzonitrile CAS Name: 3-[[4-(1,3-dithian-2-yl)phenoxy]methyl]benzonitrile IUPAC Name: 3-[[4-(1,3-dithian-2-yl)phenoxy]methyl]benzonitrile Traditional Name: 3-[[4-(1,3-dithian-2-yl)phenoxy]methyl]benzonitrile Formula: C18H17NOS2 MolecularWeight: 327.46368

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H17NOS2/c19-12-14-3-1-4-15(11-14)13-20-17-7-5-16(6-8-17)18-21-9-2-10-22-18/h1,3-8,11,18H,2,9-10,13H2