(2S)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide

Systemtic Name: (2S)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide Openeye Name: (2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide CAS Name: (2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-phenylpropanamide IUPAC Name: (2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide Traditional Name: (2S)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-phenyl-propionamide Formula: C11H13N5OS MolecularWeight: 263.31882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NNC(=N2)N

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5OS/c1-7(18-11-14-10(12)15-16-11)9(17)13-8-5-3-2-4-6-8/h2-7H,1H3,(H,13,17)(H3,12,14,15,16)/t7-/m0/s1