2-[(3-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile Openeye Name: 2-[(3-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 2-[(3-butyl-1,2,4-oxadiazol-5-yl)methylthio]-4,5,6-trimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(3-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-4,5,6-trimethylpyridine-3-carbonitrile Traditional Name: 2-[(3-butyl-1,2,4-oxadiazol-5-yl)methylthio]-4,5,6-trimethyl-nicotinonitrile Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)CSC2=NC(=C(C(=C2C#N)C)C)C

Isomeric SMILES

CCCCC1=NOC(=N1)CSC2=NC(=C(C(=C2C#N)C)C)C

InChI

InChI=1S/C16H20N4OS/c1-5-6-7-14-19-15(21-20-14)9-22-16-13(8-17)11(3)10(2)12(4)18-16/h5-7,9H2,1-4H3