(2S)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide

Systemtic Name: (2S)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide Openeye Name: (2S)-2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide CAS Name: (2S)-2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-(4-fluorophenyl)butanamide IUPAC Name: (2S)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(4-fluorophenyl)butanamide Traditional Name: (2S)-2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-(4-fluorophenyl)butyramide Formula: C15H17FN4OS MolecularWeight: 320.385083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC(=CC(=N2)N)C

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=C(C=C1)F)SC2=NC(=CC(=N2)N)C

InChI

InChI=1S/C15H17FN4OS/c1-3-12(22-15-18-9(2)8-13(17)20-15)14(21)19-11-6-4-10(16)5-7-11/h4-8,12H,3H2,1-2H3,(H,19,21)(H2,17,18,20)/t12-/m0/s1