2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)butanamide CAS Name: 2-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 2-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)butanamide Traditional Name: 2-[(3-cyano-6-methyl-2-pyridyl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)butyramide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OCC)SC3=C(C=CC(=N3)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OCC)SC3=C(C=CC(=N3)C)C#N

InChI

InChI=1S/C20H20N4O2S2/c1-4-16(27-19-13(11-21)7-6-12(3)22-19)18(25)24-20-23-15-9-8-14(26-5-2)10-17(15)28-20/h6-10,16H,4-5H2,1-3H3,(H,23,24,25)