5-ethanoyl-2-[[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-2-[[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-2-[[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-2-[[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-2-[(3-o-phenetyl-1,2,4-oxadiazol-5-yl)methylthio]nicotinonitrile Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NOC(=N2)CSC3=NC(=C(C=C3C#N)C(=O)C)C

Isomeric SMILES

CCOC1=CC=CC=C1C2=NOC(=N2)CSC3=NC(=C(C=C3C#N)C(=O)C)C

InChI

InChI=1S/C20H18N4O3S/c1-4-26-17-8-6-5-7-15(17)19-23-18(27-24-19)11-28-20-14(10-21)9-16(13(3)25)12(2)22-20/h5-9H,4,11H2,1-3H3