(2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propan-1-one

Systemtic Name: (2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propan-1-one Openeye Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propan-1-one CAS Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-phenyl-1-propanone IUPAC Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylpropan-1-one Traditional Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-phenyl-propan-1-one Formula: C11H12N4OS MolecularWeight: 248.30418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N4OS/c1-7(17-11-13-10(12)14-15-11)9(16)8-5-3-2-4-6-8/h2-7H,1H3,(H3,12,13,14,15)/t7-/m1/s1