5-ethanoyl-6-methyl-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-2-[(5-phenylisoxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 5-acetyl-6-methyl-2-[(5-phenyl-3-isoxazolyl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-6-methyl-2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-2-[(5-phenylisoxazol-3-yl)methylthio]nicotinonitrile Formula: C19H15N3O2S MolecularWeight: 349.4063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC2=NOC(=C2)C3=CC=CC=C3)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC2=NOC(=C2)C3=CC=CC=C3)C#N)C(=O)C

InChI

InChI=1S/C19H15N3O2S/c1-12-17(13(2)23)8-15(10-20)19(21-12)25-11-16-9-18(24-22-16)14-6-4-3-5-7-14/h3-9H,11H2,1-2H3