(2S)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(4-chlorophenyl)methyl]propanamide

Systemtic Name: (2S)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(4-chlorophenyl)methyl]propanamide Openeye Name: (2S)-2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-[(4-chlorophenyl)methyl]propanamide CAS Name: (2S)-2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-[(4-chlorophenyl)methyl]propanamide IUPAC Name: (2S)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-[(4-chlorophenyl)methyl]propanamide Traditional Name: (2S)-2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-(4-chlorobenzyl)propionamide Formula: C15H17ClN4OS MolecularWeight: 336.83968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C)C(=O)NCC2=CC=C(C=C2)Cl)N

Isomeric SMILES

CC1=CC(=NC(=N1)S[C@@H](C)C(=O)NCC2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C15H17ClN4OS/c1-9-7-13(17)20-15(19-9)22-10(2)14(21)18-8-11-3-5-12(16)6-4-11/h3-7,10H,8H2,1-2H3,(H,18,21)(H2,17,19,20)/t10-/m0/s1