N-(1-adamantyl)-2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[(6-amino-3,5-dicyano-2-pyridyl)thio]acetamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=C(C=C(C(=N4)N)C#N)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=C(C=C(C(=N4)N)C#N)C#N

InChI

InChI=1S/C19H21N5OS/c20-8-14-4-15(9-21)18(23-17(14)22)26-10-16(25)24-19-5-11-1-12(6-19)3-13(2-11)7-19/h4,11-13H,1-3,5-7,10H2,(H2,22,23)(H,24,25)