N-[1-(1-adamantyl)ethyl]-2-(2-cyclopropyl-5-ethanoyl-6-methyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-(2-cyclopropyl-5-ethanoyl-6-methyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: 2-(5-acetyl-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[1-(1-adamantyl)ethyl]acetamide CAS Name: 2-[(5-acetyl-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-N-[1-(1-adamantyl)ethyl]acetamide IUPAC Name: 2-(5-acetyl-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanyl-N-[1-(1-adamantyl)ethyl]acetamide Traditional Name: 2-[(5-acetyl-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]-N-[1-(1-adamantyl)ethyl]acetamide Formula: C24H33N3O2S MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4)C(=O)C

InChI

InChI=1S/C24H33N3O2S/c1-13-21(14(2)28)23(27-22(25-13)19-4-5-19)30-12-20(29)26-15(3)24-9-16-6-17(10-24)8-18(7-16)11-24/h15-19H,4-12H2,1-3H3,(H,26,29)