2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide

Systemtic Name: 2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide Openeye Name: 2-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide CAS Name: 2-[(3-cyano-6-propyl-2-pyridinyl)thio]-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide IUPAC Name: 2-(3-cyano-6-propylpyridin-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide Traditional Name: 2-[(3-cyano-6-propyl-2-pyridyl)thio]-N-homoveratryl-butyramide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SC(CC)C(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C23H29N3O3S/c1-5-7-18-10-9-17(15-24)23(26-18)30-21(6-2)22(27)25-13-12-16-8-11-19(28-3)20(14-16)29-4/h8-11,14,21H,5-7,12-13H2,1-4H3,(H,25,27)