2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-pyridin-4-yl-butanamide

Systemtic Name: 2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-pyridin-4-yl-butanamide Openeye Name: 2-[(3-cyano-6-isobutyl-2-pyridyl)sulfanyl]-N-(4-pyridyl)butanamide CAS Name: 2-[[3-cyano-6-(2-methylpropyl)-2-pyridinyl]thio]-N-pyridin-4-ylbutanamide IUPAC Name: 2-[3-cyano-6-(2-methylpropyl)pyridin-2-yl]sulfanyl-N-pyridin-4-ylbutanamide Traditional Name: 2-[(3-cyano-6-isobutyl-2-pyridyl)thio]-N-(4-pyridyl)butyramide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=NC=C1)SC2=C(C=CC(=N2)CC(C)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=NC=C1)SC2=C(C=CC(=N2)CC(C)C)C#N

InChI

InChI=1S/C19H22N4OS/c1-4-17(18(24)22-15-7-9-21-10-8-15)25-19-14(12-20)5-6-16(23-19)11-13(2)3/h5-10,13,17H,4,11H2,1-3H3,(H,21,22,24)