3-[[2-(3-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[[2-(3-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[2-(3-chlorophenyl)oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(3-chlorophenyl)-4-oxazolyl]methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[[2-(3-chlorophenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(3-chlorophenyl)oxazol-4-yl]methylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C15H15ClN4O2S MolecularWeight: 350.8232

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=COC(=N2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=COC(=N2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H15ClN4O2S/c1-2-6-20-14(21)18-19-15(20)23-9-12-8-22-13(17-12)10-4-3-5-11(16)7-10/h3-5,7-8H,2,6,9H2,1H3,(H,18,21)