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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[2-(4-fluorophenyl)ethyl]ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[2-(4-fluorophenyl)ethyl]acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-[2-(4-fluorophenyl)ethyl]acetamide Formula: C14H16FN5OS MolecularWeight: 321.373143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CSC2=NC(=CC(=N2)N)N)F

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CSC2=NC(=CC(=N2)N)N)F

InChI

InChI=1S/C14H16FN5OS/c15-10-3-1-9(2-4-10)5-6-18-13(21)8-22-14-19-11(16)7-12(17)20-14/h1-4,7H,5-6,8H2,(H,18,21)(H4,16,17,19,20)