N-(2-adamantylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-(2-adamantylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-(2-adamantylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[(2-adamantylamino)-sulfanylidenemethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-(2-adamantylcarbamothioyl)-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-(2-adamantylthiocarbamoyl)piazthiole-5-carboxamide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=S)NC(=O)C4=CC5=NSN=C5C=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=S)NC(=O)C4=CC5=NSN=C5C=C4

InChI

InChI=1S/C18H20N4OS2/c23-17(11-1-2-14-15(8-11)22-25-21-14)20-18(24)19-16-12-4-9-3-10(6-12)7-13(16)5-9/h1-2,8-10,12-13,16H,3-7H2,(H2,19,20,23,24)