N-[1-(1-adamantyl)propyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-(methylthio)nicotinamide Formula: C20H28N2OS MolecularWeight: 344.51412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(N=CC=C4)SC

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(N=CC=C4)SC

InChI

InChI=1S/C20H28N2OS/c1-3-17(22-18(23)16-5-4-6-21-19(16)24-2)20-10-13-7-14(11-20)9-15(8-13)12-20/h4-6,13-15,17H,3,7-12H2,1-2H3,(H,22,23)