N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[(5E)-4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl]ethyl]adamantane-1-carboxamide Formula: C24H26N2O4S2 MolecularWeight: 470.60424

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCN4C(=O)C(=CC5=CC6=C(C=C5)OCO6)SC4=S

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCN4C(=O)/C(=C\C5=CC6=C(C=C5)OCO6)/SC4=S

InChI

InChI=1S/C24H26N2O4S2/c27-21-20(9-14-1-2-18-19(8-14)30-13-29-18)32-23(31)26(21)4-3-25-22(28)24-10-15-5-16(11-24)7-17(6-15)12-24/h1-2,8-9,15-17H,3-7,10-13H2,(H,25,28)/b20-9+