[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate CAS Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoic acid [(2S)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl] 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoic acid [(1S)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C14H15N3O4S MolecularWeight: 321.3516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)CSC2=CC=CC=C2C(=O)OC(C)C(=O)N

Isomeric SMILES

CC1=NOC(=N1)CSC2=CC=CC=C2C(=O)O[C@@H](C)C(=O)N

InChI

InChI=1S/C14H15N3O4S/c1-8(13(15)18)20-14(19)10-5-3-4-6-11(10)22-7-12-16-9(2)17-21-12/h3-6,8H,7H2,1-2H3,(H2,15,18)/t8-/m0/s1