6-(4-methoxyphenyl)-2-(2-oxidanylidenepropylsulfanyl)-4-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-(2-oxidanylidenepropylsulfanyl)-4-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-acetonylsulfanyl-6-(4-methoxyphenyl)-4-(2-thienyl)pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-(2-oxopropylthio)-4-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-(2-oxopropylsulfanyl)-4-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-(acetonylthio)-6-(4-methoxyphenyl)-4-(2-thienyl)nicotinonitrile Formula: C20H16N2O2S2 MolecularWeight: 380.48324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CS3)C#N

Isomeric SMILES

CC(=O)CSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CS3)C#N

InChI

InChI=1S/C20H16N2O2S2/c1-13(23)12-26-20-17(11-21)16(19-4-3-9-25-19)10-18(22-20)14-5-7-15(24-2)8-6-14/h3-10H,12H2,1-2H3