N-(2-adamantyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-adamantyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-adamantyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2-adamantyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2-adamantyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2-adamantyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C18H25N3OS MolecularWeight: 331.4756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2C3CC4CC(C3)CC2C4)C

InChI

InChI=1S/C18H25N3OS/c1-10-3-11(2)20-18(19-10)23-9-16(22)21-17-14-5-12-4-13(7-14)8-15(17)6-12/h3,12-15,17H,4-9H2,1-2H3,(H,21,22)