N'-cyano-2-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanimidamide

Systemtic Name: N'-cyano-2-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-ethanimidamide Openeye Name: N'-cyano-2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]acetamidine CAS Name: N'-cyano-2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]ethanimidamide IUPAC Name: N'-cyano-2-[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanylethanimidamide Traditional Name: N'-cyano-2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]thio]acetamidine Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=NC#N)N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=NC#N)N)C3=CC=CC=C3

InChI

InChI=1S/C22H17N5OS/c1-28-17-9-7-15(8-10-17)18-11-20(16-5-3-2-4-6-16)27-22(19(18)12-23)29-13-21(25)26-14-24/h2-11H,13H2,1H3,(H2,25,26)