3-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: 3-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Openeye Name: 3-[(3-cyano-6-isopropyl-2-pyridyl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide CAS Name: 3-[(3-cyano-6-propan-2-yl-2-pyridinyl)thio]-N-(3,5-dimethoxyphenyl)propanamide IUPAC Name: 3-(3-cyano-6-propan-2-ylpyridin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 3-[(3-cyano-6-isopropyl-2-pyridyl)thio]-N-(3,5-dimethoxyphenyl)propionamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC(C)C1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C20H23N3O3S/c1-13(2)18-6-5-14(12-21)20(23-18)27-8-7-19(24)22-15-9-16(25-3)11-17(10-15)26-4/h5-6,9-11,13H,7-8H2,1-4H3,(H,22,24)