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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC(=CC(=N2)N)N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC(=CC(=N2)N)N)C

InChI

InChI=1S/C15H19N5OS/c1-3-10-6-4-5-9(2)14(10)20-13(21)8-22-15-18-11(16)7-12(17)19-15/h4-7H,3,8H2,1-2H3,(H,20,21)(H4,16,17,18,19)