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

Systemtic Name: 4-[2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 4-[2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]thiazol-4-yl]benzonitrile CAS Name: 4-[2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-4-thiazolyl]benzonitrile IUPAC Name: 4-[2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]-1,3-thiazol-4-yl]benzonitrile Traditional Name: 4-[2-[[4-(1,3-dithiolan-2-yl)phenoxy]methyl]thiazol-4-yl]benzonitrile Formula: C20H16N2OS3 MolecularWeight: 396.54884

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)OCC3=NC(=CS3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)OCC3=NC(=CS3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H16N2OS3/c21-11-14-1-3-15(4-2-14)18-13-26-19(22-18)12-23-17-7-5-16(6-8-17)20-24-9-10-25-20/h1-8,13,20H,9-10,12H2