2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2,4,4-trimethylpentan-2-yl)ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2,4,4-trimethylpentan-2-yl)ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(1,1,3,3-tetramethylbutyl)acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(2,4,4-trimethylpentan-2-yl)acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2,4,4-trimethylpentan-2-yl)acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(1,1,3,3-tetramethylbutyl)acetamide Formula: C14H25N5OS MolecularWeight: 311.4462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)CSC1=NC(=CC(=N1)N)N

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)CSC1=NC(=CC(=N1)N)N

InChI

InChI=1S/C14H25N5OS/c1-13(2,3)8-14(4,5)19-11(20)7-21-12-17-9(15)6-10(16)18-12/h6H,7-8H2,1-5H3,(H,19,20)(H4,15,16,17,18)