2-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 2-(3-cyano-6-propan-2-yl-pyridin-2-yl)sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Openeye Name: 2-[(3-cyano-6-isopropyl-2-pyridyl)sulfanyl]-N-(4-phenylthiazol-2-yl)butanamide CAS Name: 2-[(3-cyano-6-propan-2-yl-2-pyridinyl)thio]-N-(4-phenyl-2-thiazolyl)butanamide IUPAC Name: 2-(3-cyano-6-propan-2-ylpyridin-2-yl)sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Traditional Name: 2-[(3-cyano-6-isopropyl-2-pyridyl)thio]-N-(4-phenylthiazol-2-yl)butyramide Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)C2=CC=CC=C2)SC3=C(C=CC(=N3)C(C)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)C2=CC=CC=C2)SC3=C(C=CC(=N3)C(C)C)C#N

InChI

InChI=1S/C22H22N4OS2/c1-4-19(29-21-16(12-23)10-11-17(24-21)14(2)3)20(27)26-22-25-18(13-28-22)15-8-6-5-7-9-15/h5-11,13-14,19H,4H2,1-3H3,(H,25,26,27)