4-[[2-oxidanylidene-2-[(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)amino]ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-oxidanylidene-2-[(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)amino]ethyl]amino]butanoic acid Openeye Name: 4-[[2-oxo-2-[(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)amino]ethyl]amino]butanoic acid CAS Name: 4-[[2-oxo-2-[[3-(propylthio)-1,2,4-thiadiazol-5-yl]amino]ethyl]amino]butanoic acid IUPAC Name: 4-[[2-oxo-2-[(3-propylsulfanyl-1,2,4-thiadiazol-5-yl)amino]ethyl]amino]butanoic acid Traditional Name: 4-[[2-keto-2-[[3-(propylthio)-1,2,4-thiadiazol-5-yl]amino]ethyl]amino]butyric acid Formula: C11H18N4O3S2 MolecularWeight: 318.41562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NSC(=N1)NC(=O)CNCCCC(=O)O

Isomeric SMILES

CCCSC1=NSC(=N1)NC(=O)CNCCCC(=O)O

InChI

InChI=1S/C11H18N4O3S2/c1-2-6-19-11-14-10(20-15-11)13-8(16)7-12-5-3-4-9(17)18/h12H,2-7H2,1H3,(H,17,18)(H,13,14,15,16)