5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate

Systemtic Name: 5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate Openeye Name: 5-(2-morpholino-2-oxo-ethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate CAS Name: 5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-phenyl-1,2,4-triazol-3-olate IUPAC Name: 5-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-4-phenyl-1,2,4-triazol-3-olate Traditional Name: 5-[(2-keto-2-morpholino-ethyl)thio]-4-phenyl-1,2,4-triazol-3-olate Formula: C14H15N4O3S- MolecularWeight: 319.3589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NN=C(N2C3=CC=CC=C3)[O-]

Isomeric SMILES

C1COCCN1C(=O)CSC2=NN=C(N2C3=CC=CC=C3)[O-]

InChI

InChI=1S/C14H16N4O3S/c19-12(17-6-8-21-9-7-17)10-22-14-16-15-13(20)18(14)11-4-2-1-3-5-11/h1-5H,6-10H2,(H,15,20)/p-1