2-[2-(4-cyanophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-(dimethoxymethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-cyanophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-(dimethoxymethyl)pyridine-3-carbonitrile Openeye Name: 2-[2-(4-cyanophenyl)-2-oxo-ethyl]sulfanyl-6-(dimethoxymethyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(4-cyanophenyl)-2-oxoethyl]thio]-6-(dimethoxymethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-cyanophenyl)-2-oxoethyl]sulfanyl-6-(dimethoxymethyl)pyridine-3-carbonitrile Traditional Name: 2-[[2-(4-cyanophenyl)-2-keto-ethyl]thio]-6-(dimethoxymethyl)nicotinonitrile Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=NC(=C(C=C1)C#N)SCC(=O)C2=CC=C(C=C2)C#N)OC

Isomeric SMILES

COC(C1=NC(=C(C=C1)C#N)SCC(=O)C2=CC=C(C=C2)C#N)OC

InChI

InChI=1S/C18H15N3O3S/c1-23-18(24-2)15-8-7-14(10-20)17(21-15)25-11-16(22)13-5-3-12(9-19)4-6-13/h3-8,18H,11H2,1-2H3