N-(1-adamantyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(1-adamantyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(1-adamantyl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(1-adamantyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(1-adamantyl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(1-adamantyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C24H23NO4S MolecularWeight: 421.50872

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6S5(=O)=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6S5(=O)=O

InChI

InChI=1S/C24H23NO4S/c26-22-18-3-1-2-4-20(18)30(28,29)21-10-17(5-6-19(21)22)23(27)25-24-11-14-7-15(12-24)9-16(8-14)13-24/h1-6,10,14-16H,7-9,11-13H2,(H,25,27)