N-(3-chloranyl-4-methoxy-phenyl)-3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]thio]propionamide Formula: C23H20ClN3O3S MolecularWeight: 453.9412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20ClN3O3S/c1-29-18-7-3-15(4-8-18)20-9-5-16(14-25)23(27-20)31-12-11-22(28)26-17-6-10-21(30-2)19(24)13-17/h3-10,13H,11-12H2,1-2H3,(H,26,28)