2-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]sulfanyl]acetamide CAS Name: 2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]thio]acetamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H19N3O2S/c1-27-19-10-7-17(8-11-19)20-12-9-18(13-23)22(25-20)28-15-21(26)24-14-16-5-3-2-4-6-16/h2-12H,14-15H2,1H3,(H,24,26)