2-[[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]benzimidazol-1-yl]methyl]pentanedinitrile

Systemtic Name: 2-[[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]benzimidazol-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[2-[(1,1-dioxothiolan-3-yl)methyl]benzimidazol-1-yl]methyl]pentanedinitrile CAS Name: 2-[[2-[(1,1-dioxo-3-thiolanyl)methyl]-1-benzimidazolyl]methyl]pentanedinitrile IUPAC Name: 2-[[2-[(1,1-dioxothiolan-3-yl)methyl]benzimidazol-1-yl]methyl]pentanedinitrile Traditional Name: 2-[[2-[(1,1-diketothiolan-3-yl)methyl]benzimidazol-1-yl]methyl]glutaronitrile Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1CC2=NC3=CC=CC=C3N2CC(CCC#N)C#N

Isomeric SMILES

C1CS(=O)(=O)CC1CC2=NC3=CC=CC=C3N2CC(CCC#N)C#N

InChI

InChI=1S/C18H20N4O2S/c19-8-3-4-15(11-20)12-22-17-6-2-1-5-16(17)21-18(22)10-14-7-9-25(23,24)13-14/h1-2,5-6,14-15H,3-4,7,9-10,12-13H2