N-(5-chloranylpyridin-2-yl)-3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(5-chloro-2-pyridyl)-3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]propanamide CAS Name: N-(5-chloro-2-pyridinyl)-3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]propanamide IUPAC Name: N-(5-chloropyridin-2-yl)-3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanylpropanamide Traditional Name: N-(5-chloro-2-pyridyl)-3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]propionamide Formula: C28H23ClN4O3S MolecularWeight: 531.02522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=NC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=NC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C28H23ClN4O3S/c1-35-20-9-10-25(36-2)22(14-20)21-15-24(18-6-4-3-5-7-18)32-28(23(21)16-30)37-13-12-27(34)33-26-11-8-19(29)17-31-26/h3-11,14-15,17H,12-13H2,1-2H3,(H,31,33,34)