2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(2,4-dimethylphenyl)-4-oxazolyl]methylthio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[[2-(2,4-dimethylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[[2-(2,4-dimethylphenyl)oxazol-4-yl]methylthio]-4,6-dimethyl-nicotinonitrile Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=C(C(=CC(=N3)C)C)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CO2)CSC3=C(C(=CC(=N3)C)C)C#N)C

InChI

InChI=1S/C20H19N3OS/c1-12-5-6-17(13(2)7-12)19-23-16(10-24-19)11-25-20-18(9-21)14(3)8-15(4)22-20/h5-8,10H,11H2,1-4H3