N-[1-(1-adamantyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C20H29N3OS MolecularWeight: 359.52876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC(C)C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC(C)C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C20H29N3OS/c1-12-4-13(2)22-19(21-12)25-11-18(24)23-14(3)20-8-15-5-16(9-20)7-17(6-15)10-20/h4,14-17H,5-11H2,1-3H3,(H,23,24)