N-(1-adamantyl)-6-[(5E)-2-oxidanylidene-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide

Systemtic Name: N-(1-adamantyl)-6-[(5E)-2-oxidanylidene-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide Openeye Name: N-(1-adamantyl)-6-[(5E)-5-benzylidene-2-oxo-4-thioxo-thiazolidin-3-yl]hexanamide CAS Name: N-(1-adamantyl)-6-[(5E)-2-oxo-5-(phenylmethylene)-4-sulfanylidene-3-thiazolidinyl]hexanamide IUPAC Name: N-(1-adamantyl)-6-[(5E)-5-benzylidene-2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanamide Traditional Name: N-(1-adamantyl)-6-[(5E)-5-benzal-2-keto-4-thioxo-thiazolidin-3-yl]hexanamide Formula: C26H32N2O2S2 MolecularWeight: 468.67448

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCCCN4C(=S)C(=CC5=CC=CC=C5)SC4=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCCCN4C(=S)/C(=C\C5=CC=CC=C5)/SC4=O

InChI

InChI=1S/C26H32N2O2S2/c29-23(27-26-15-19-11-20(16-26)13-21(12-19)17-26)9-5-2-6-10-28-24(31)22(32-25(28)30)14-18-7-3-1-4-8-18/h1,3-4,7-8,14,19-21H,2,5-6,9-13,15-17H2,(H,27,29)/b22-14+