N-(1-adamantylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(1-adamantylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(1-adamantylmethyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C19H24N4OS2 MolecularWeight: 388.55006

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CN4C(=NNC4=S)C5=CC=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CN4C(=NNC4=S)C5=CC=CS5

InChI

InChI=1S/C19H24N4OS2/c24-16(10-23-17(21-22-18(23)25)15-2-1-3-26-15)20-11-19-7-12-4-13(8-19)6-14(5-12)9-19/h1-3,12-14H,4-11H2,(H,20,24)(H,22,25)