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

Systemtic Name: 3-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(2,4-dimethylphenyl)-4-oxazolyl]methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=COC(=N2)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=COC(=N2)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C17H20N4O2S/c1-4-7-21-16(22)19-20-17(21)24-10-13-9-23-15(18-13)14-6-5-11(2)8-12(14)3/h5-6,8-9H,4,7,10H2,1-3H3,(H,19,22)